SCHEMBL10487648

SCHEMBL10487648

Nn1cccc1C(=O)c1ccc(Cl)cc1Cl

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.68
HSD17B10 Q99714 1/20 0.68
SRD5A2 P31213 1/20 0.50
TSHR P16473 1/20 0.47
CASP1 P29466 1/20 0.47
MAPT P10636 3/20 0.46
KDM4E B2RXH2 2/20 0.46
KMT2A Q03164 5/20 0.46
MEN1 O00255 4/20 0.46
POLB P06746 2/20 0.46
CYP2C9 P11712 2/20 0.46
ALDH1A1 P00352 2/20 0.44
MAPK1 P28482 1/20 0.44
HIF1A Q16665 1/20 0.44
HTT P42858 1/20 0.43
RAB9A P51151 2/20 0.43
CYP2C19 P33261 3/20 0.43
CYP1A2 P05177 2/20 0.43
RECQL P46063 1/20 0.43
HPGD P15428 2/20 0.40

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 SCHEMBL10487607 0.98 SMN1; SMN2 (0.67) SMN1; SMN2HSD17B10SRD5A2TSHRCASP1
SCHEMBL10365113 0.82 CNR2 (0.49) SMN1; SMN2HSD17B10KMT2AMEN1POLB
SCHEMBL11728744 0.81 SMN1; SMN2 (1.00) SMN1; SMN2HSD17B10SRD5A2TSHRCASP1
SCHEMBL10487806 0.77 SMN1; SMN2 (0.62) SMN1; SMN2HSD17B10SRD5A2TSHRCASP1
SCHEMBL9689290 0.77 SMN1; SMN2 (0.66) SMN1; SMN2HSD17B10SRD5A2TSHRCASP1
SCHEMBL9689174 0.76 SMN1; SMN2 (0.64) SMN1; SMN2HSD17B10SRD5A2TSHRCASP1
SCHEMBL9689264 0.76 SMN1; SMN2 (0.64) SMN1; SMN2HSD17B10SRD5A2TSHRCASP1
SCHEMBL10487745 0.76 SMN1; SMN2 (0.60) SMN1; SMN2HSD17B10SRD5A2MAPTKDM4E
SCHEMBL30185351 0.75 SMN1; SMN2 (0.71) SMN1; SMN2HSD17B10SRD5A2TSHRCASP1
SCHEMBL195020 0.75 SMN1; SMN2 (0.71) SMN1; SMN2HSD17B10SRD5A2TSHRCASP1

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-4883794-A ANALGESICS, ANTICHOLINERGIC AGENTS HOECHST-ROUSSEL PHARMACEUTICALS, INC. (US) 1989-11-28 US disclosed
EP-0308912-A2 Pyrrolo(1,2-b)cinnolines, a process for their preparation and their use as medicaments HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1989-03-29 EP disclosed
US-4800203-A ANALGESICS HOECHST-ROUSSEL PHARMACEUTICALS, INC. (US) 1989-01-24 US disclosed