SCHEMBL9375873

SCHEMBL9375873

O=C1c2ccc(Cl)cc2C(=O)N1CCCCCl

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.49
ALDH1A1 P00352 4/20 0.49
MEN1 O00255 2/20 0.49
HTT P42858 2/20 0.49
KMT2A Q03164 2/20 0.49
RGS12 O14924 1/20 0.49
NPC1 O15118 1/20 0.49
LMNA P02545 1/20 0.49
PABPC1 P11940 1/20 0.49
RECQL P46063 1/20 0.49
RAB9A P51151 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
MAPK1 P28482 1/20 0.48
HSD17B10 Q99714 1/20 0.48
HTR1A P08908 1/20 0.47
DRD2 P14416 1/20 0.47
HTR2A P28223 1/20 0.47
ACHE P22303 4/20 0.47
TSHR P16473 1/20 0.45

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
SCHEMBL9383842 0.85 ALDH1A1 (0.48) KDM4EALDH1A1KMT2ASMN1; SMN2MAPK1
SCHEMBL2892202 0.84 CNR2 (0.50) ACHE
SCHEMBL10451411 0.84 CNR2 (0.50) ACHE
SCHEMBL2884714 0.83 KDM4E (0.49) KDM4EALDH1A1MEN1HTTKMT2A
SCHEMBL2884712 0.80 TDP1 (0.61) RAB9ASMN1; SMN2
SCHEMBL10779928 0.79 KDM4E (0.46) KDM4EALDH1A1MEN1HTTKMT2A
SCHEMBL5878681 0.79 KDM4E (0.69) KDM4EALDH1A1MEN1HTTKMT2A
SCHEMBL30632351 0.79 TDP1 (0.64) MEN1KMT2ARAB9ASMN1; SMN2
SCHEMBL6786134 0.79 TDP1 (0.64) MEN1KMT2ARAB9ASMN1; SMN2
SCHEMBL9536378 0.79 TDP1 (0.64) MEN1KMT2ARAB9ASMN1; 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
EP-0625978-A1 PIPERAZINE AND PIPERIDINE DERIVATIVES, AND THEIR USE AS ANTIPSYCHOTICS THE WELLCOME FOUNDATION LIMITED (GB) 1994-11-30 EP disclosed
WO-1993016073-A1 PIPERAZINE AND PIPERIDINE DERIVATIVES, AND THEIR USE AS ANTIPSYCHOTICS THE WELLCOME FOUNDATION LIMITED (GB) 1993-08-19 WO disclosed