SCHEMBL3417072

SCHEMBL3417072

Cc1ccc(-c2nc(C(=O)O)c(C)s2)cc1

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.61
RAB9A P51151 2/20 0.61
GAA P10253 2/20 0.61
ALDH1A1 P00352 2/20 0.53
RARA P10276 2/20 0.51
RARB P10826 2/20 0.51
RARG P13631 2/20 0.51
ALOX5 P09917 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.46
NPC1 O15118 1/20 0.46
POLB P06746 1/20 0.46
TRPM8 Q7Z2W7 1/20 0.46
MEN1 O00255 1/20 0.44
LMNA P02545 1/20 0.44
MAPT P10636 1/20 0.44
KMT2A Q03164 1/20 0.44

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
SCHEMBL3995172 0.88 RARA (0.60) KDM4EGAAALDH1A1RARARARB
SCHEMBL6503223 0.87 RARA (0.49) KDM4ERAB9AGAARARARARB
SCHEMBL6496085 0.87 KDM4E (0.63) KDM4ERAB9AGAAALDH1A1RARA
SCHEMBL9823302 0.84 PTGDR2 (0.53) KDM4ERAB9AGAAALDH1A1ALOX5
SCHEMBL6496395 0.81 PIN1 (0.54) KDM4EALDH1A1RARARARBRARG
SCHEMBL9823522 0.81 RAB9A (0.55) KDM4ERAB9AGAAALDH1A1RARA
SCHEMBL6502484 0.81 L3MBTL1 (0.58) KDM4ERAB9AGAAALDH1A1ALOX5
SCHEMBL6504818 0.80 RAB9A (0.44) KDM4ERAB9AGAARARARARB
SCHEMBL6497499 0.79 CDC7 (0.49) KDM4ERAB9AGAARARARARB
SCHEMBL5554758 0.77 TBK1 (0.56) KDM4ERAB9AGAAALDH1A1ALOX5

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7687664-B2 Carboxylic acid derivative, a salt thereof or an ester of them, and medicament comprising it EISAI R&D MANAGEMENT CO., LTD. (JP) 2010-03-30 US disclosed
US-6884821-B1 Carboxylic acid derivatives and drugs containing the same EISAI CO., LTD. (JP) 2005-04-26 US disclosed
US-20040214888-A1 Carboxylic acid derivative and medicine comprising salt or ester of the same EISAI R&D MANAGEMENT CO., LTD. (JP) 2004-10-28 US disclosed
EP-1394147-A1 CARBOXYLIC ACID DERIVATIVE AND MEDICINE COMPRISING SALT OR ESTER OF THE SAME Eisai Co., Ltd. (JP) 2004-03-03 EP disclosed
EP-1216980-A1 CARBOXYLIC ACID DERIVATIVES AND DRUGS CONTAINING THE SAME Eisai Co., Ltd. (JP) 2002-06-26 EP disclosed
EP-0262873-B1 N-TETRAZOLYL THIAZOLECARBOXAMIDE DERIVATIVES AND THEIR USE SAWAI PHARMACEUTICAL CO., LTD. (JP) 1991-08-21 EP disclosed
US-4879295-A ANTIALLERGENS SAWAI PHARMACEUTICAL CO., LTD. (JP) 1989-11-07 US disclosed
EP-0262873-A1 N-tetrazolyl thiazolecarboxamide derivatives and their use SAWAI PHARMACEUTICAL CO., LTD. (JP) 1988-04-06 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 (1 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-20040214888-A1 Carboxylic acid derivative and medicine comprising salt or ester of the same GPR119, NR3C1, INSR KDM4E 3724/4885RAB9A 3699/4885GAA 1991/4885

“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.