SCHEMBL9737314

SCHEMBL9737314

Cc1ccc(C(C)C)c(OCCN2CCN(c3ccc(Cl)cc3)CC2)c1

nearest known ligand 0.57

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ATM Q13315 3/20 0.54
MEN1 O00255 1/20 0.54
KMT2A Q03164 1/20 0.54
HTR1A P08908 4/20 0.50
HTR2A P28223 3/20 0.50
ADRB2 P07550 2/20 0.50
ALDH1A1 P00352 3/20 0.49
TSHR P16473 2/20 0.49
KDM4E B2RXH2 2/20 0.49
SLC6A2 P23975 1/20 0.46
SLC6A4 P31645 1/20 0.46
SLC6A3 Q01959 1/20 0.46
MAPT P10636 1/20 0.46
DRD2 P14416 1/20 0.46
DRD3 P35462 1/20 0.46
TMEM97 Q5BJF2 1/20 0.46
SIGMAR1 Q99720 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
HSD17B10 Q99714 1/20 0.46

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
Hydrochloric Acid SCHEMBL9737100 0.99 ATM (0.56) ATMMEN1KMT2AHTR1AHTR2A
SCHEMBL9737496 0.89 ATM (0.54) ATMMEN1KMT2AHTR1AADRB2
SCHEMBL9739717 0.88 ATM (0.62) ATMMEN1KMT2AHTR1AHTR2A
Hydrochloric Acid SCHEMBL9741521 0.88 ATM (0.54) ATMMEN1KMT2AHTR2AADRB2
SCHEMBL9737244 0.88 DRD2 (0.54) ATMMEN1KMT2AHTR1AHTR2A
Hydrochloric Acid SCHEMBL9736783 0.88 ATM (0.56) ATMMEN1KMT2AHTR1AADRB2
Hydrochloric Acid SCHEMBL9736847 0.87 ATM (0.64) ATMMEN1KMT2AHTR1AHTR2A
Hydrochloric Acid SCHEMBL9736860 0.87 ATM (0.64) ATMMEN1KMT2AHTR1AHTR2A
Hydrochloric Acid SCHEMBL9735824 0.87 DRD2 (0.55) ATMMEN1KMT2AHTR1AHTR2A
SCHEMBL9741672 0.86 ATM (0.52) ATMMEN1KMT2AHTR1AHTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5110816-A Urogenital disorders INSTITUT DE RECHERCHES CHIMIQUES ET BIOLOGIQUES APPLIQUEES (I.R.C.E.B.A.) (FR) 1992-05-05 US disclosed