SCHEMBL8916889

SCHEMBL8916889

Fc1cccc2scc(N3CC[N]CC3)c12

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.36
RAB9A P51151 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
TSHR P16473 2/20 0.35
NPC1 O15118 1/20 0.35
CASP3 P42574 1/20 0.35
SENP8 Q96LD8 1/20 0.35
SENP7 Q9BQF6 1/20 0.35
SENP6 Q9GZR1 1/20 0.35
MAPT P10636 9/20 0.33
TP53 P04637 7/20 0.33
LMNA P02545 4/20 0.33
ALDH1A1 P00352 3/20 0.32
KDM4E B2RXH2 2/20 0.32
POLB P06746 1/20 0.32
DRD4 P21917 1/20 0.31
DRD3 P35462 1/20 0.31
USP2 O75604 1/20 0.31
MAPK1 P28482 1/20 0.31
THRB P10828 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
SCHEMBL8920541 0.82 ADRB1 (0.34) MAPTTP53LMNAALDH1A1KDM4E
SCHEMBL8915792 0.70 MAPT (0.58) MAPTTP53LMNAUSP2THRB
SCHEMBL8917207 0.70 ALDH1A1 (0.35) SMN1; SMN2TSHRALDH1A1KDM4EPOLB
SCHEMBL1367739 0.69 ADRB1 (0.42) SMN1; SMN2TSHRALDH1A1KDM4EPOLB
SCHEMBL30938252 0.68 SMN1; SMN2 (0.35) SMN1; SMN2RAB9AL3MBTL1TSHRNPC1
SCHEMBL6329505 0.65 CA2 (0.38) SMN1; SMN2RAB9ATSHRNPC1MAPT
SCHEMBL2094381 0.64 SMN1; SMN2 (0.32) SMN1; SMN2RAB9ANPC1MAPTLMNA
SCHEMBL28388316 0.64 SMN1; SMN2 (0.36) SMN1; SMN2RAB9ATSHRNPC1CASP3
SCHEMBL2091686 0.64 MRGPRX1 (0.40) SMN1; SMN2RAB9ATSHRNPC1MAPT
SCHEMBL31158808 0.64 SMN1; SMN2 (0.40) SMN1; SMN2RAB9ATSHRNPC1MAPT

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-5532240-A ANTIPSYCHOTIC AGENTS AND ANTISEROTONIN AGENTS YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1996-07-02 US claimed
US-5691330-A ANTIPSYCHOTIC AGENT YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1997-11-25 US disclosed
US-5532240-A ANTIPSYCHOTIC AGENTS AND ANTISEROTONIN AGENTS YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1996-07-02 US disclosed