SCHEMBL14985274

SCHEMBL14985274

C=Cc1ccncc1C=C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IMPDH2 P12268 2/20 0.42
CCNC P24863 1/20 0.33
CDK8 P49336 1/20 0.33
HTT P42858 1/20 0.32
ALDH1A1 P00352 4/20 0.32
KDM4E B2RXH2 2/20 0.31
CYP1A2 P05177 2/20 0.31
CYP3A4 P08684 2/20 0.31
LMNA P02545 2/20 0.31
ACHE P22303 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
MAPKAPK2 P49137 1/20 0.31
GABRP O00591 1/20 0.31
GABRD O14764 1/20 0.31
IKBKB O14920 1/20 0.31
AURKA O14965 1/20 0.31
CHUK O15111 1/20 0.31
PIM1 P11309 1/20 0.31

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
SCHEMBL23127914 0.86 IMPDH2 (0.34) IMPDH2CCNCCDK8
SCHEMBL16230072 0.86 IMPDH2 (0.38) IMPDH2CCNCCDK8SIGMAR1
SCHEMBL18901576 0.84 IMPDH2 (0.37) IMPDH2CCNCCDK8ALDH1A1GAA
SCHEMBL18381481 0.83 IMPDH2 (0.36) IMPDH2CCNCCDK8HTT
SCHEMBL22664548 0.83 IMPDH2 (0.36) IMPDH2CCNCCDK8ALDH1A1LMNA
SCHEMBL12508937 0.83 IMPDH2 (0.33) IMPDH2CCNCCDK8
SCHEMBL399636 0.83 IMPDH2 (0.36) IMPDH2CCNCCDK8
SCHEMBL18477270 0.83 IMPDH2 (0.36) IMPDH2CCNCCDK8
SCHEMBL23655929 0.81 IMPDH2 (0.35) IMPDH2ALDH1A1
SCHEMBL19068072 0.81 IMPDH2 (0.35) IMPDH2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119685928-A Method for controlling density of single-walled carbon nanotube horizontal array by regulating and controlling width of crystal face step 中国科学院金属研究所 2025-03-25 CN disclosed
CN-103261087-B chromophoric polymer dots 华盛顿大学商业化中心 2018-08-10 CN disclosed
WO-2013078466-A1 PYRAZINE KINASE INHIBITORS PORTOLA PHARMACEUTICALS, INC. (US) 2013-05-30 WO disclosed