SCHEMBL8639372

SCHEMBL8639372

CCCCCP(CCCCC)c1ccccn1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.41
GAA P10253 1/20 0.41
HTT P42858 4/20 0.41
LMNA P02545 3/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
ALOX12 P18054 2/20 0.41
ALOX15 P16050 2/20 0.41
USP2 O75604 1/20 0.41
NPC1 O15118 1/20 0.41
HSP90AA1 P07900 1/20 0.41
RAB9A P51151 1/20 0.41
CYP1A2 P05177 2/20 0.40
CYP2C19 P33261 2/20 0.40
CYP2D6 P10635 1/20 0.40
CYP19A1 P11511 1/20 0.40
CYP2C9 P11712 1/20 0.40
ALDH1A1 P00352 1/20 0.36
TSHR P16473 1/20 0.36
KCNA5 P22460 1/20 0.35
KCNH2 Q12809 1/20 0.35

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
SCHEMBL21277327 0.96 KDM4E (0.41) KDM4EGAAHTTLMNASMN1; SMN2
SCHEMBL21277337 0.95 KDM4E (0.40) KDM4EGAAHTTLMNASMN1; SMN2
SCHEMBL8159587 0.94 KDM4E (0.42) KDM4EGAAHTTLMNASMN1; SMN2
SCHEMBL9335635 0.93 KDM4E (0.41) KDM4EGAAHTTLMNASMN1; SMN2
SCHEMBL8146536 0.79 KDM4E (0.42) KDM4EGAAHTTLMNASMN1; SMN2
SCHEMBL9472479 0.79 KCNH2 (0.44) KCNH2
SCHEMBL8160677 0.78 KDM4E (0.48) KDM4EGAALMNANPC1RAB9A
SCHEMBL18412107 0.76 KDM4E (0.37) KDM4EGAAHTTLMNASMN1; SMN2
SCHEMBL19230192 0.75 HTT (0.32) KDM4EGAAHTTSMN1; SMN2ALOX15
SCHEMBL9335973 0.74 CYP1A2 (0.41) KDM4EGAAHTTLMNASMN1; SMN2

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
EP-0499328-B1 Process for the preparation of diarylphosphino pyridines SHELL INT RESEARCH (NL) 1998-04-29 EP claimed
JP-5092984-A None JP disclosed
JP-H0592984-A PRODUCTION OF DIARYLPHOSPHINOPYRIDINE SHELL INTERNATL RES MAATSCHAPPIJ BV 1993-04-16 JP disclosed