SCHEMBL325037

SCHEMBL325037

N#Cc1cccn2ccnc12

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CDK2 P24941 1/20 0.43
NUDT1 P36639 1/20 0.41
KDM4D Q6B0I6 1/20 0.38
ADRA1A P35348 2/20 0.38
KDM4E B2RXH2 2/20 0.37
ALDH1A1 P00352 2/20 0.37
HPGD P15428 1/20 0.37
CLK4 Q9HAZ1 1/20 0.37
HTT P42858 1/20 0.37
CYP19A1 P11511 1/20 0.37
ELANE P08246 3/20 0.36
MALT1 Q9UDY8 1/20 0.36
PIK3CG P48736 1/20 0.34
TSHR P16473 1/20 0.33
LMNA P02545 1/20 0.33
GLA P06280 1/20 0.33
CNR2 P34972 1/20 0.33
PDE4A P27815 1/20 0.33
PDE3A Q14432 1/20 0.33

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
Hydrochloric Acid SCHEMBL31194792 0.98 CDK2 (0.42) CDK2NUDT1KDM4DADRA1AKDM4E
SCHEMBL3112689 0.81 NUDT1 (0.41) NUDT1PDE4APDE3A
SCHEMBL3759218 0.81 NUDT1 (0.41) NUDT1
SCHEMBL12618990 0.74 NUDT1 (0.38) CDK2NUDT1KDM4DKDM4EALDH1A1
SCHEMBL30549535 0.73 CDK2 (0.61) CDK2KDM4DADRA1AKDM4EALDH1A1
SCHEMBL31156498 0.72 CDK2 (0.50) CDK2NUDT1KDM4DKDM4EALDH1A1
SCHEMBL31466725 0.72 CYP19A1 (0.36) CDK2KDM4EALDH1A1CYP19A1TSHR
SCHEMBL15743453 0.72 ALDH1A1 (0.47) KDM4EALDH1A1HPGDCLK4HTT
SCHEMBL26476230 0.72 ADORA3 (0.46) CDK2KDM4DKDM4EALDH1A1HPGD
SCHEMBL25319736 0.71 SGMS2 (0.38) CDK2ALDH1A1HTTCYP19A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112805280-B Heteroaryl compounds for the treatment of huntington's disease PTC医疗公司 2024-12-06 CN claimed
EP-3814345-B1 HETEROARYL COMPOUNDS FOR TREATING HUNTINGTON'S DISEASE PTC THERAPEUTICS INC (US) 2024-09-25 EP claimed
EP-2231660-A1 IMIDAZO [1,2-A] PYRIDINE COMPOUNDS Wyeth LLC (US) 2010-09-29 EP claimed
WO-2009086123-A1 IMIDAZO [1,2-A] PYRIDINE COMPOUNDS WYETH (US) 2009-07-09 WO claimed
EP-4739691-A1 SUBSTITUTED PYRIDYL/PYRAZINYL DIHYDROPYRROLOTRIAZINE COMPOUNDS FOR COMBATTING PHYTOPATH-OGENIC FUNGI BASF SE (DE) 2026-05-13 EP disclosed
EP-4739690-A1 SUBSTITUTED QUINOLYL/QUINOXALYL DIHYDROPYRROLOTRIAZINE COMPOUNDS FOR COMBATTING PHYTO-PATHOGENIC FUNGI BASF SE (DE) 2026-05-13 EP disclosed
US-20250353841-A1 HETEROCYCLIC COMPOUNDS FOR TREATING HUNTINGTON'S DISEASE HUFF SARAH ELIZABETH (US) 2025-11-20 US disclosed
WO-2025078181-A1 FUNGICIDAL MIXTURE COMPRISING SUBSTITUTED PYRIDINES BASF SE (DE) 2025-04-17 WO disclosed
WO-2025078183-A1 FUNGICIDAL MIXTURE COMPRISING SUBSTITUTED QUINAZOLYL QUINOLINES BASF SE (DE) 2025-04-17 WO disclosed
WO-2025031843-A1 NEW SUBSTITUTED BENZOXAZINE PICOLINONITRILE COMPOUNDS FOR COMBATTING PHYTOPATHOGENIC FUNGI BASF SE (DE) 2025-02-13 WO disclosed
WO-2025031842-A1 NEW SUBSTITUTED BENZOXAZEPINE PICOLINONITRILE COMPOUNDS FOR COMBATTING PHYTOPATHOGENIC FUNGI BASF SE (DE) 2025-02-13 WO disclosed
WO-2025008227-A1 SUBSTITUTED PYRIDYL/PYRAZINYL DIHYDROPYRROLOTRIAZINE COMPOUNDS FOR COMBATTING PHYTOPATH-OGENIC FUNGI BASF SE (DE) 2025-01-09 WO disclosed
US-20080287445-A1 Prokineticin 2 receptor antagonists JANSSEN PHARMACEUTICA N.V. (BE) 2008-11-20 US disclosed
US-20080287445-A1 Prokineticin 2 receptor antagonists JANSSEN PHARMACEUTICA N.V. (BE) 2008-11-20 US disclosed
US-20080269225-A1 Prokineticin 1 receptor antagonists JANSSEN PHARMACEUTICA N.V. (BE) 2008-10-30 US disclosed
US-20080269225-A1 Prokineticin 1 receptor antagonists JANSSEN PHARMACEUTICA N.V. (BE) 2008-10-30 US disclosed
EP-1976528-A2 PROKINETICIN 2 RECEPTOR ANTAGONISTS Janssen Pharmaceutica, N.V. (BE) 2008-10-08 EP disclosed
WO-2007079214-A2 PROKINETICIN 2 RECEPTOR ANTAGONISTS JANSSEN PHARMACEUTICA N.V. (BE) 2007-07-12 WO disclosed
WO-2007079214-A2 PROKINETICIN 2 RECEPTOR ANTAGONISTS JANSSEN PHARMACEUTICA N.V. (BE) 2007-07-12 WO disclosed
WO-2007079163-A2 PROKINETICIN 1 RECEPTOR ANTAGONISTS JANSSEN PHARMACEUTICA N.V. (BE) 2007-07-12 WO 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 (3 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-20250353841-A1 HETEROCYCLIC COMPOUNDS FOR TREATING HUNTINGTON'S DISEASE HTT, HYPK, ATXN2 CDK2 2559/4885NUDT1 266/4885KDM4D 2949/4885
US-20080269225-A1 Prokineticin 1 receptor antagonists PROKR1, PROKR2, GIPR CDK2 1206/4885NUDT1 2468/4885KDM4D 4855/4885
US-20080287445-A1 Prokineticin 2 receptor antagonists PROKR2, PROKR1, GIPR CDK2 800/4885NUDT1 2931/4885KDM4D 4842/4885

“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.