SCHEMBL9716496

SCHEMBL9716496

OCCn1cnc(-c2ccc(Cl)cc2Cl)n1

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MARS1 P56192 3/20 0.47
CRHR1 P34998 2/20 0.45
HSD11B1 P28845 2/20 0.41
ALPL P05186 1/20 0.39
DPP4 P27487 1/20 0.39
DPP8 Q6V1X1 1/20 0.39
NPC1 O15118 1/20 0.38
KDM4C Q9H3R0 1/20 0.37
SPR P35270 1/20 0.37
KCNH2 Q12809 1/20 0.36

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
SCHEMBL28196508 0.72 ALPL (0.44) MARS1CRHR1HSD11B1ALPLDPP4
SCHEMBL13748979 0.71 HDAC1 (0.40)
SCHEMBL10748355 0.71 KDM4C (0.42) MARS1HSD11B1ALPLNPC1KDM4C
SCHEMBL4932128 0.70 IDO1 (0.40) CRHR1KCNH2
SCHEMBL4932130 0.69 ADRA2C (0.35) MARS1CRHR1SPRKCNH2
SCHEMBL12373654 0.69 HDAC1 (0.35)
SCHEMBL5106102 0.68 KMT2A (0.37) MARS1CRHR1NPC1
SCHEMBL4932106 0.68 CRHR1 (0.36) MARS1CRHR1HSD11B1NPC1
SCHEMBL4932111 0.68 MARS1 (0.35) MARS1CRHR1
SCHEMBL1072714 0.68 LMNA (0.35) MARS1CRHR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0485213-A1 Aquatic antifouling compositions ROHM AND HAAS COMPANY (US) 1992-05-13 EP disclosed