SCHEMBL9819792

SCHEMBL9819792

CCCCCCCOc1ccc(CNC(=O)C(O)CO)cc1

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FAAH O00519 3/20 0.52
S1PR2 O95136 2/20 0.50
S1PR1 P21453 2/20 0.50
S1PR3 Q99500 2/20 0.50
LPAR2 Q9HBW0 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.49
LMNA P02545 1/20 0.49
TP53 P04637 1/20 0.49
TSHR P16473 1/20 0.49
SPHK1 Q9NYA1 1/20 0.48

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
SCHEMBL1695202 0.81 TP53 (0.60) FAAHS1PR2S1PR1S1PR3LPAR2
SCHEMBL9308211 0.81 FAAH (0.63) FAAHS1PR2S1PR1S1PR3LPAR2
SCHEMBL28827967 0.80 FAAH (0.65) FAAHS1PR2S1PR1S1PR3LPAR2
SCHEMBL5222701 0.76 FAAH (0.63) FAAHSMN1; SMN2LMNA
SCHEMBL14111813 0.76 EPHX2 (0.58) FAAHSMN1; SMN2LMNA
SCHEMBL9307359 0.75 SMN1; SMN2 (0.67) SMN1; SMN2LMNATP53TSHR
SCHEMBL9565606 0.74 FAAH (0.73) FAAH
SCHEMBL7507343 0.74 TP53 (0.59) LMNATP53TSHR
SCHEMBL8953576 0.74 TP53 (0.59) LMNATP53TSHR
SCHEMBL3031391 0.74 S1PR2 (0.49) S1PR2S1PR1S1PR3LPAR2SMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4987132-A PLATELET ACTIVATING FACTOR ANTAGONISTS YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1991-01-22 US disclosed
EP-0279681-A2 Saturated heterocyclic carboxamide derivatives YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1988-08-24 EP disclosed