SCHEMBL21667892

SCHEMBL21667892

CC(C)OCCCN1CCC(O)C1

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 11/20 0.49
HRH2 P25021 5/20 0.46
HRH1 P35367 5/20 0.46
HTR1A P08908 1/20 0.44
PDCD1 Q15116 1/20 0.39
CD274 Q9NZQ7 1/20 0.39
LTA4H P09960 1/20 0.39

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
SCHEMBL9917378 1.00 HRH3 (0.49) HRH3HRH2HRH1HTR1APDCD1
SCHEMBL9917377 1.00 HRH3 (0.49) HRH3HRH2HRH1HTR1APDCD1
SCHEMBL22281966 0.90 HTR1A (0.54) HRH3HRH2HRH1HTR1A
SCHEMBL20729427 0.90 HTR1A (0.54) HRH3HRH2HRH1HTR1A
SCHEMBL20729452 0.90 HTR1A (0.54) HRH3HRH2HRH1HTR1A
SCHEMBL8501119 0.90 HRH3 (0.43) HRH3HRH2HRH1
SCHEMBL9911416 0.90 LTA4H (0.43) HRH3HRH2HRH1HTR1ALTA4H
SCHEMBL12872466 0.90 LTA4H (0.43) HRH3HRH2HRH1HTR1ALTA4H
SCHEMBL9911415 0.90 LTA4H (0.43) HRH3HRH2HRH1HTR1ALTA4H
SCHEMBL26239366 0.87 HRH3 (0.47) HRH3HRH2HRH1HTR1APDCD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11759458-B2 Indane-amines as PD-L1 antagonists CHEMOCENTRYX, INC. (US) 2023-09-19 US disclosed
US-11708326-B2 Immunomodulator compounds CHEMOCENTRYX, INC. (US) 2023-07-25 US disclosed
US-11691985-B2 Macrocyclic immunomodulators CHEMOCENTRYX, INC. (US) 2023-07-04 US disclosed
US-11672800-B2 Combination therapies with EHMT2 inhibitors Epizyme, Inc. (US) 2023-06-13 US disclosed
EP-4105203-A1 SPIRO-CONDENSED INDOLE COMPOUNDS AS EHMT2 INHIBITORS Epizyme Inc (US) 2022-12-21 EP disclosed
EP-3519393-B1 SUBSTITUTED FUSED BI- OR TRI- HETEROCYCLIC COMPOUNDS AS EHMT2 INHIBITORS EPIZYME INC (US) 2022-05-18 EP disclosed
US-20200317642-A1 AMINE-SUBSTITUTED HETEROCYCLIC COMPOUNDS AS EHMT2 INHIBITORS AND DERIVATIVES THEREOF Epizyme, Inc. 2020-10-08 US disclosed
US-20200054635-A1 COMBINATION THERAPIES WITH EHMT2 INHIBITORS Epizyme, Inc. 2020-02-20 US disclosed
US-20200039961-A1 SUBSTITUTED FUSED BI- OR TRI- HETEROCYCLIC COMPOUNDS AS EHMT2 INHIBITORS Epizyme, Inc. 2020-02-06 US 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 (7 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-11708326-B2 Immunomodulator compounds IL2, FCGRT, IFNG HRH3 143/4885HRH2 110/4885HRH1 166/4885
US-11691985-B2 Macrocyclic immunomodulators IL2, IL2RA, C3AR1 HRH3 162/4885HRH2 158/4885HRH1 234/4885
US-20200317642-A1 AMINE-SUBSTITUTED HETEROCYCLIC COMPOUNDS AS EHMT2 INHIBITORS AND DERIVATIVES THEREOF HNMT, EHMT2, SHMT2 HRH3 641/4885HRH2 1094/4885HRH1 1475/4885
US-20200039961-A1 SUBSTITUTED FUSED BI- OR TRI- HETEROCYCLIC COMPOUNDS AS EHMT2 INHIBITORS SHMT1, BHMT, EHMT2 HRH3 1654/4885HRH2 2338/4885HRH1 2096/4885
US-20200054635-A1 COMBINATION THERAPIES WITH EHMT2 INHIBITORS EHMT2, BHMT, SHMT2 HRH3 2154/4885HRH2 2900/4885HRH1 3557/4885
US-11672800-B2 Combination therapies with EHMT2 inhibitors EHMT2, BHMT, SHMT2 HRH3 2154/4885HRH2 2900/4885HRH1 3557/4885
US-11759458-B2 Indane-amines as PD-L1 antagonists CD274, PDCD1LG2, PDCD1 HRH3 11/4885HRH2 21/4885HRH1 18/4885

“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.