SCHEMBL11626342

SCHEMBL11626342

O=C(O)Cc1ccc2oc(-c3ccc(Cl)cc3)nc2c1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPSE Q9Y251 11/20 0.72
KDM4E B2RXH2 2/20 0.65
MAPT P10636 1/20 0.59
MAOA P21397 1/20 0.59
ADRA1A P35348 1/20 0.59
NPC1 O15118 1/20 0.58
RAB9A P51151 1/20 0.58
ALDH1A1 P00352 1/20 0.57
POLB P06746 1/20 0.57
HPGD P15428 1/20 0.57
PPARG P37231 1/20 0.57
SMN1; SMN2 Q16637 1/20 0.57
HSD17B10 Q99714 1/20 0.57
NR2E3 Q9Y5X4 1/20 0.57
NCOR2 Q9Y618 1/20 0.57
KDR P35968 1/20 0.57
CASP3 P42574 1/20 0.57
SENP8 Q96LD8 1/20 0.57
SENP7 Q9BQF6 1/20 0.57
SENP6 Q9GZR1 1/20 0.57

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
Methane SCHEMBL505763 0.99 HPSE (0.70) HPSEKDM4EMAPTMAOAADRA1A
Methane SCHEMBL25304065 0.97 HPSE (0.69) HPSEKDM4EMAPTMAOAADRA1A
SCHEMBL5052834 0.88 CASP3 (0.59) HPSEKDM4EMAPTMAOAADRA1A
Methane SCHEMBL11176675 0.88 HPSE (0.57) HPSEKDM4EMAPTMAOAADRA1A
SCHEMBL507169 0.88 KDM4E (0.77) HPSEKDM4ENPC1RAB9AALDH1A1
SCHEMBL5461475 0.87 HPSE (0.72) HPSEKDM4EMAPTNPC1RAB9A
SCHEMBL9820079 0.87 HPSE (0.72) HPSEKDM4EMAPTSMN1; SMN2GAA
SCHEMBL14581706 0.86 HPSE (0.70) HPSEKDM4ENPC1RAB9APOLB
Methane SCHEMBL506232 0.86 HPSE (0.70) HPSEKDM4EMAPTSMN1; SMN2GAA
Methane SCHEMBL5476423 0.86 HPSE (0.70) HPSEKDM4EMAPTNPC1RAB9A

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-4087437-A FORMATION OF AMMONIUM SALT THEREOF, THERMALLY RECONVERTING SALT TO THE ACID ELI LILLY AND COMPANY (US) 1978-05-02 US disclosed