SCHEMBL101547

SCHEMBL101547

CC(C)c1ccnc(C(=O)O)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.55
ALDH1A1 P00352 3/20 0.55
ASPH Q12797 2/20 0.55
KDM8 Q8N371 2/20 0.55
KDM4C Q9H3R0 2/20 0.55
KDM5A P29375 2/20 0.55
KDM3A Q9Y4C1 2/20 0.55
KDM6B O15054 1/20 0.55
TET3 O43151 1/20 0.55
KDM4A O75164 1/20 0.55
BBOX1 O75936 1/20 0.55
MAPT P10636 1/20 0.55
KDM5C P41229 1/20 0.55
KDM4D Q6B0I6 1/20 0.55
TET2 Q6N021 1/20 0.55
ALKBH5 Q6P6C2 1/20 0.55
KDM7A Q6ZMT4 1/20 0.55
TET1 Q8NFU7 1/20 0.55
EGLN2 Q96KS0 1/20 0.55
FTO Q9C0B1 1/20 0.55

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL12258250 0.87 KDM4E (0.56) KDM4EALDH1A1ASPHKDM8KDM4C
SCHEMBL10872507 0.85 KDM4E (0.54) KDM4EALDH1A1ASPHKDM8KDM4C
SCHEMBL29272073 0.85 KDM4E (0.52) KDM4EALDH1A1ASPHKDM8KDM4C
SCHEMBL31032261 0.85 KDM4E (0.52) KDM4EALDH1A1ASPHKDM8KDM4C
SCHEMBL6169475 0.85 ALDH1A1 (0.47) KDM4EALDH1A1ASPHKDM8KDM4C
SCHEMBL25687802 0.85 KDM4E (0.55) KDM4EALDH1A1ASPHKDM8KDM4C
SCHEMBL10204249 0.83 RAF1 (0.43) KDM4EALDH1A1ASPHKDM8KDM4C
SCHEMBL18542887 0.83 KDM4C (0.40) KDM4EALDH1A1ASPHKDM8KDM4C
SCHEMBL23760240 0.82 KDM4E (0.57) KDM4EALDH1A1ASPHKDM8KDM4C
SCHEMBL31032209 0.82 KDM4E (0.49) KDM4EALDH1A1ASPHKDM8KDM4C

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 67 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230263784-A1 COMBINATION THERAPY USING A CHEMOKINE RECEPTOR 2 (CCR2) ANTAGONIST AND A PD-1/PD-L1 INHIBITOR CHEMOCENTRYX, INC. 2023-08-24 US disclosed
US-20230263784-A1 COMBINATION THERAPY USING A CHEMOKINE RECEPTOR 2 (CCR2) ANTAGONIST AND A PD-1/PD-L1 INHIBITOR CHEMOCENTRYX, INC. 2023-08-24 US disclosed
US-11624089-B2 Cyanine dyes PACIFIC BIOSCIENCES OF CALIFORNIA, INC. (US) 2023-04-11 US disclosed
US-20230023075-A1 COMBINATION THERAPY USING A CHEMOKINE RECEPTOR 2 (CCR2) ANTAGONIST AND A PD-1/PD-L1 INHIBITOR CHEMOCENTRYX, INC. 2023-01-26 US disclosed
WO-2022272060-A1 EP2 ANTAGONIST COMPOUNDS RESERVOIR NEUROSCIENCE, INC. (US) 2022-12-29 WO disclosed
US-11304952-B2 Combination therapy using a chemokine receptor 2 (CCR2) antagonist and a PD-1/PD-L1 inhibitor CHEMOCENTRYX, INC. (US) 2022-04-19 US disclosed
US-20220112166-A1 Selective JAK2 Pseudokinase Ligands and Methods of Use YALE UNIVERSITY 2022-04-14 US disclosed
CN-111449083-A Low-temperature acidic cleaning composition and preparation method and application thereof 上海柯珑清洁技术有限公司 2020-07-28 CN disclosed
US-20200232023-A1 CYANINE DYES PACIFIC BIOSCIENCES OF CALIFORNIA, INC. 2020-07-23 US disclosed
US-10464934-B2 Substituted tetrahydropyrans as CCR2 modulators CHEMOCENTRYX, INC. (US) 2019-11-05 US disclosed
EP-1654268-A2 LINCOMYCIN DERIVATIVES POSSESSING ANTIBACTERIAL ACTIVITY Vicuron Pharmaceuticals, Inc. (US) 2006-05-10 EP disclosed
CN-1681832-A Lincomycin derivatives possessing antibacterial activity VICURON PHARM INC (US) 2005-10-12 CN disclosed
EP-1529052-A2 LINCOMYCIN DERIVATIVES POSSESSING ANTIBACTERIAL ACTIVITY Vicuron Pharmaceuticals, Inc. (US) 2005-05-11 EP disclosed
WO-2005007665-A2 LINCOMYCIN DERIVATIVES POSSESSING ANTIBACTERIAL ACTIVITY VICURON PHARMACEUTICALS INC. (US) 2005-01-27 WO disclosed
US-20040230046-A1 Lincomycin derivatives possessing antibacterial activity VICURON PHARMACEUTICALS INC. 2004-11-18 US disclosed
US-20040116690-A1 Lincomycin derivatives possessing antibacterial activity VICURON PHARMACEUTICALS INC. 2004-06-17 US disclosed
WO-2004016632-A2 LINCOMYCIN DERIVATIVES POSSESSING ANTIBACTERIAL ACTIVITY VICURON PHARMACEUTICALS, INC. (US) 2004-02-26 WO disclosed
EP-0053789-B1 2-PYRIDINECARBOXAMIDE DERIVATIVE, PROCESS FOR PREPARING SAME AND PHARMACEUTICAL COMPOSITION, USEFUL AS AN ANTI-ALLERGIC AGENT Tanabe Seiyaku Co., Ltd. (JP) 1985-03-27 EP disclosed
US-4404214-A 2-Pyridinecarboxamide derivatives compositions containing same and method of using same TANABE SEIYAKU CO., LTD. (JP) 1983-09-13 US disclosed
EP-0053789-A1 2-Pyridinecarboxamide derivative, process for preparing same and pharmaceutical composition, useful as an anti-allergic agent Tanabe Seiyaku Co., Ltd. (JP) 1982-06-16 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (8 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10464934-B2 Substituted tetrahydropyrans as CCR2 modulators CCR2, CCR1, CCR5 KDM4E 4548/4885ALDH1A1 1316/4885ASPH 3541/4885
US-20040230046-A1 Lincomycin derivatives possessing antibacterial activity NRDC, NISCH, CLSPN KDM4E 3921/4885ALDH1A1 2737/4885ASPH 3214/4885
US-11624089-B2 Cyanine dyes ABCG2, IK, ACR KDM4E 2687/4885ALDH1A1 1447/4885ASPH 411/4885
US-20200232023-A1 CYANINE DYES ABCG2, IK, ACR KDM4E 2687/4885ALDH1A1 1447/4885ASPH 411/4885
US-20220112166-A1 Selective JAK2 Pseudokinase Ligands and Methods of Use JAK2, JAK1, MCL1 KDM4E 1336/4885ALDH1A1 3690/4885ASPH 2140/4885
US-20230023075-A1 COMBINATION THERAPY USING A CHEMOKINE RECEPTOR 2 (CCR2) ANTAGONIST AND A PD-1/PD-L1 INHIBITOR CCR2, PDCD1LG2, CD274 KDM4E 3769/4885ALDH1A1 1295/4885ASPH 4473/4885
US-11304952-B2 Combination therapy using a chemokine receptor 2 (CCR2) antagonist and a PD-1/PD-L1 inhibitor CCR2, PDCD1LG2, CD274 KDM4E 3769/4885ALDH1A1 1295/4885ASPH 4473/4885
US-20230263784-A1 COMBINATION THERAPY USING A CHEMOKINE RECEPTOR 2 (CCR2) ANTAGONIST AND A PD-1/PD-L1 INHIBITOR CCR2, PDCD1LG2, CD274 KDM4E 3769/4885ALDH1A1 1295/4885ASPH 4473/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.