SCHEMBL29664462

SCHEMBL29664462

O=Cc1c[nH]c2cnccc12

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCNT1 O60563 1/20 0.62
CDK9 P50750 1/20 0.62
HASPIN Q8TF76 1/20 0.62
CYP2A6 P11509 2/20 0.56
IMPDH2 P12268 1/20 0.56
DYRK1A Q13627 9/20 0.51
NFATC1 O95644 6/20 0.51
GSK3B P49841 4/20 0.51
KMT2A Q03164 1/20 0.50
ALDH1A1 P00352 2/20 0.46
KDM4E B2RXH2 1/20 0.46
MAPT P10636 1/20 0.46
PDPK1 O15530 1/20 0.45
TGFBR1 P36897 1/20 0.45
IKBKE Q14164 1/20 0.45
PLG P00747 1/20 0.44
PLAU P00749 1/20 0.44
CDK2 P24941 2/20 0.43
DYRK1B Q9Y463 2/20 0.43
IGF1R P08069 1/20 0.43

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
SCHEMBL2268299 1.00 CCNT1 (0.62) CCNT1CDK9HASPINCYP2A6IMPDH2
Hydrochloric Acid SCHEMBL3831446 0.98 CCNT1 (0.60) CCNT1CDK9HASPINCYP2A6IMPDH2
SCHEMBL2263957 0.85 CCNT1 (0.62) CCNT1CDK9HASPINCYP2A6IMPDH2
SCHEMBL27773730 0.81 DYRK1A (0.51) CCNT1CDK9HASPINDYRK1ANFATC1
SCHEMBL4268145 0.77 CCNT1 (0.65) CCNT1CDK9HASPINDYRK1ANFATC1
SCHEMBL4268142 0.77 CCNT1 (0.65) CCNT1CDK9HASPINDYRK1ANFATC1
SCHEMBL3594684 0.76 CCNT1 (0.56) CCNT1CDK9HASPINCYP2A6IMPDH2
SCHEMBL26700908 0.75 CCNT1 (0.58) CCNT1CDK9HASPINCYP2A6IMPDH2
3-Formylindole SCHEMBL29082887 0.74 CYP2A6 (0.77) CCNT1CDK9HASPINCYP2A6IMPDH2
SCHEMBL23600353 0.74 CGAS (0.51) CCNT1CDK9HASPINDYRK1ANFATC1

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-4719396-A2 NON-PEPTIDE SMALL MOLECULE FGF14:NAV1.6 CHANNEL COMPLEX PROTEIN-PROTEIN INTERACTION MODULATORS THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2026-04-08 EP disclosed
US-12559487-B2 Crosslinked optically active secondary amine derivative Sumitomo Pharma Co., Ltd. (JP) 2026-02-24 US disclosed
EP-4688776-A1 1-H-PYRROLO[2,3-C]PYRIDINE COMPOUNDS ACTING AGAINST CANCER VIA AGONISM OF MENIN Acerta Pharma B.V. (NL) 2026-02-11 EP disclosed
WO-2024254218-A2 NON-PEPTIDE SMALL MOLECULE FGF14:NAV1.6 CHANNEL COMPLEX PROTEIN-PROTEIN INTERACTION MODULATORS THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2024-12-12 WO disclosed
WO-2024201240-A1 1-H-PYRROLO[2,3-C]PYRIDINE COMPOUNDS ACTING AGAINST CANCER VIA AGONISM OF MENIN ACERTA PHARMA B.V. (NL) 2024-10-03 WO disclosed
CN-118139864-A New compounds 西特瑞治疗有限公司 2024-06-04 CN disclosed
CN-110526854-B Alpha, beta-unsaturated ketone derivative, preparation method and application thereof as medicine 宁夏医科大学 2023-12-15 CN disclosed
US-20220380365-A1 CROSSLINKED OPTICALLY ACTIVE SECONDARY AMINE DERIVATIVE SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2022-12-01 US disclosed
EP-4003997-A1 DIHYDROPYRIMIDINE DERIVATIVES AND USES THEREOF IN THE TREATMENT OF HBV INFECTION OR OF HBV-INDUCED DISEASES Janssen Sciences Ireland Unlimited Company (IE) 2022-06-01 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 (2 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-20220380365-A1 CROSSLINKED OPTICALLY ACTIVE SECONDARY AMINE DERIVATIVE MLLT3, MLLT1, MEN1 CCNT1 1288/4885CDK9 307/4885HASPIN 1466/4885
US-12559487-B2 Crosslinked optically active secondary amine derivative MLLT3, MLLT1, FLI1 CCNT1 1200/4885CDK9 489/4885HASPIN 3131/4885

“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.