SCHEMBL9037102

SCHEMBL9037102

CCNC(C)(O)C1CCCCC1

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SSTR4 P31391 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.34
MEN1 O00255 1/20 0.34
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.34
ALOX12 P18054 1/20 0.34
KMT2A Q03164 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
EPHX1 P07099 3/20 0.33
CYP1A2 P05177 1/20 0.32
CHRM2 P08172 1/20 0.32
CYP2D6 P10635 1/20 0.32
CHRM1 P11229 1/20 0.32
KCNH2 Q12809 1/20 0.32
PDK1 Q15118 1/20 0.32
PDK2 Q15119 1/20 0.32
PDK3 Q15120 1/20 0.32
PDK4 Q16654 1/20 0.32
HSD17B10 Q99714 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
SCHEMBL13726495 0.98 SSTR4 (0.33) SSTR4SMN1; SMN2MEN1ALDH1A1LMNA
SCHEMBL27722675 0.93
SCHEMBL11457439 0.78 MEN1 (0.35) SSTR4SMN1; SMN2MEN1ALDH1A1LMNA
SCHEMBL28176698 0.77 EPHX1 (0.32) SMN1; SMN2MEN1ALDH1A1LMNAALOX12
SCHEMBL28176697 0.75 MEN1 (0.33) SSTR4SMN1; SMN2MEN1ALDH1A1LMNA
SCHEMBL28159316 0.75 SSTR4 (0.38) SSTR4SMN1; SMN2MEN1ALDH1A1LMNA
SCHEMBL28159363 0.75 SSTR4 (0.38) SSTR4SMN1; SMN2MEN1ALDH1A1LMNA
SCHEMBL28175814 0.74 CA1 (0.30)
SCHEMBL28175792 0.74 CYP1A2 (0.33) ALDH1A1EPHX1CYP1A2CHRM2CYP2D6
SCHEMBL28175813 0.72 MEN1 (0.30) SMN1; SMN2MEN1ALDH1A1LMNAALOX12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0450066-B1 CARBOSTYRIL DERIVATIVES OTSUKA PHARMA CO LTD (JP) 1996-09-11 EP disclosed
US-5401740-A FOR INHIBITING PLATELET AGGREGATION OTSUKA PHARMACEUTICAL CO. (JP) 1995-03-28 US disclosed
US-5227381-A Anticoagulant OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1993-07-13 US disclosed
EP-0450066-A1 CARBOSTYRIL DERIVATIVES OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1991-10-09 EP disclosed