SCHEMBL29549639

SCHEMBL29549639

CCc1c(-c2ccccc2C)nc2c(C#N)c[nH]n2c1=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ KDM5A P29375 16/20 1.00
▸ KDM4E B2RXH2 4/20 0.67
▸ ALDH1A1 P00352 1/20 0.67
▸ LMNA P02545 1/20 0.67
▸ HSD17B10 Q99714 1/20 0.67
▸ CYP2C9 P11712 2/20 0.59
▸ GAA P10253 1/20 0.59
▸ CYP2D6 P10635 1/20 0.59
▸ FPR1 P21462 1/20 0.59
▸ CYP2C19 P33261 1/20 0.59
▸ KDM6B O15054 1/20 0.53
▸ KDM5C P41229 1/20 0.53
▸ KDM5D Q9BY66 1/20 0.53
▸ KDM4C Q9H3R0 1/20 0.53
▸ KDM5B Q9UGL1 1/20 0.53
▸ PHF8 Q9UPP1 1/20 0.53

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
SCHEMBL29549478 0.69 KDM5A (1.00) KDM5AKDM6BKDM5CKDM5DKDM4C
Hydrochloric Acid SCHEMBL31236648 0.68 KDM5A (0.98) KDM5AKDM6BKDM5CKDM5DKDM4C
SCHEMBL16077821 0.64 KDM5A (0.47) KDM5AKDM4EALDH1A1LMNAHSD17B10
SCHEMBL2124113 0.63 KDM5A (0.46) KDM5AKDM6BKDM5CKDM5DKDM4C
SCHEMBL6642827 0.61 KDM5A (0.50) KDM5AKDM4EALDH1A1LMNAHSD17B10
SCHEMBL2124746 0.61 KDM5A (0.52) KDM5AGAAKDM6BKDM5CKDM5D
SCHEMBL24309881 0.60 ADORA2A (0.51) KDM5AKDM4ELMNAHSD17B10
SCHEMBL826541 0.60 KDM5A (0.58) KDM5AKDM4EALDH1A1LMNAHSD17B10
SCHEMBL16966518 0.59 HEXA (0.59) KDM5ACYP2D6
SCHEMBL10000551 0.58 TSHR (0.52) KDM5AALDH1A1LMNA

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
EP-4058604-B1 COMPOSITIONS AND METHODS FOR REGULATING EGFR AMPLIFICATION IN CANCER CELLS FOR IMPROVING EGFR-TARGETED ANTI-CANCER AGENT INSTITUTE FOR CANCER RES (US) 2026-04-22 — — EP disclosed
US-20220411879-A1 COMPOSITIONS AND METHODS FOR REGULATING EGFR AMPLIFICATION IN CANCER CELLS FOR IMPROVING EFFICACY OF EGFR-TARGETED ANTI-CANCER AGENTS THE GENERAL HOSPITAL CORPORATION 2022-12-29 — — US disclosed
EP-4058604-A1 COMPOSITIONS AND METHODS FOR REGULATING EGFR AMPLIFICATION IN CANCER CELLS FOR IMPROVING EGFR-TARGETED ANTI-CANCER AGENT Institute For Cancer Research d/b/a The Research Institute of Fox Chase Cancer Center (US) 2022-09-21 — — EP disclosed
US-20220192984-A1 PHARMACEUTICAL COMPOSITIONS COMPRISING OTIC THERAPEUTIC AGENTS AND RELATED METHODS Frequency Therapeutics, Inc. 2022-06-23 — — US disclosed
US-20220175776-A1 COMBINATION OF CHIR99021 AND VALPROIC ACID FOR TREATING HEARING LOSS Frequency Therapeutics, Inc. (US) 2022-06-09 — — US disclosed
US-20220160664-A1 TAZ ACTIVATORS AND WNT AGONISTS FOR TREATING EAR DISORDERS UNITED STATES GOVERNMENT 2022-05-26 — — US disclosed
US-20220127568-A1 COMPOSITIONS AND METHODS FOR GENERATING HAIR CELLS BY INHIBITING EPIGENETIC TARGETS Frequency Therapeutics, Inc. (US) 2022-04-28 — — US disclosed
CN-114340611-A Combination of CHIR99021 and valproic acid for the treatment of hearing loss 频率医疗公司 2022-04-12 — — CN disclosed
EP-3952854-A1 COMBINATION OF CHIR99021 AND VALPROIC ACID FOR TREATING HEARING LOSS Frequency Therapeutics, Inc. (US) 2022-02-16 — — 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 (4 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-20220127568-A1 COMPOSITIONS AND METHODS FOR GENERATING HAIR CELLS BY INHIBITING EPIGENETIC TARGETS WNT3A, WNT1, MECP2 KDM5A 291/4885KDM4E 154/4885ALDH1A1 1696/4885
US-20220175776-A1 COMBINATION OF CHIR99021 AND VALPROIC ACID FOR TREATING HEARING LOSS HES1, SHH, HDAC11 KDM5A 760/4885KDM4E 523/4885ALDH1A1 588/4885
US-20220160664-A1 TAZ ACTIVATORS AND WNT AGONISTS FOR TREATING EAR DISORDERS WNT1, WNT3A, CTNNB1 KDM5A 4354/4885KDM4E 3207/4885ALDH1A1 2821/4885
US-20220192984-A1 PHARMACEUTICAL COMPOSITIONS COMPRISING OTIC THERAPEUTIC AGENTS AND RELATED METHODS OTC, EXOSC5, ENTPD5 KDM5A 4642/4885KDM4E 4618/4885ALDH1A1 2267/4885

“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.

Send feedback