SCHEMBL10691015

SCHEMBL10691015

[CH2]C([CH2])Sc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.45
MAPT P10636 2/20 0.45
HPGD P15428 1/20 0.45
MGLL Q99685 1/20 0.45
HSD17B10 Q99714 1/20 0.45
MAPK1 P28482 4/20 0.39
ALDH1A1 P00352 3/20 0.39
LMNA P02545 2/20 0.36
MAOA P21397 2/20 0.34
MAOB P27338 2/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
L3MBTL1 Q9Y468 3/20 0.33
PKM P14618 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
POLB P06746 1/20 0.32
FFAR1 O14842 1/20 0.32

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
SCHEMBL1453376 0.78 MAOA (0.41) SMN1; SMN2MAPTHPGDMGLLHSD17B10
SCHEMBL1226276 0.78 SMN1; SMN2 (0.41) SMN1; SMN2MAPTHPGDMGLLHSD17B10
SCHEMBL19458653 0.76 LMNA (0.41) SMN1; SMN2MAPTHPGDMGLLHSD17B10
SCHEMBL1713865 0.75 SMN1; SMN2 (0.50) SMN1; SMN2MAPTHPGDMGLLHSD17B10
SCHEMBL9690804 0.72 MAPK1 (0.37) SMN1; SMN2MAPTHPGDMGLLHSD17B10
SCHEMBL7975341 0.72 ALDH1A1 (0.40) SMN1; SMN2MAPTHPGDMGLLHSD17B10
SCHEMBL343269 0.71 SMN1; SMN2 (0.45) SMN1; SMN2MAPTHPGDMGLLHSD17B10
SCHEMBL777177 0.71 SMN1; SMN2 (0.46) SMN1; SMN2MAPTHPGDMGLLHSD17B10
SCHEMBL2392316 0.71 SMN1; SMN2 (0.45) SMN1; SMN2MAPTHPGDMGLLHSD17B10
SCHEMBL3911663 0.71 SMN1; SMN2 (0.45) SMN1; SMN2MAPTHPGDMGLLHSD17B10

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
US-4792550-A THROMBOXANE ANTAGONIST-HYPOTENSIVE AGENT; CARDIOVASCULAR, NERVOUS SYSTEM DISORDERS; ANTIALLERGENS ONO PHARMACEUTICAL CO., LTD. (JP) 1988-12-20 US disclosed
EP-0171146-B1 13-AZA-14-OXO-TXA2 ANALOGUES ONO PHARMACEUTICAL CO., LTD. (JP) 1988-09-28 EP disclosed
EP-0171146-A1 13-Aza-14-oxo-txa2 analogues ONO PHARMACEUTICAL CO., LTD. (JP) 1986-02-12 EP disclosed