SCHEMBL10368251

SCHEMBL10368251

CC(CN1c2ccccc2Sc2cc(Br)ccc21)N(C)C

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP2D6 P10635 7/20 0.76
▸ CHRM2 P08172 6/20 0.76
▸ HTR1A P08908 6/20 0.76
▸ CHRM1 P11229 6/20 0.76
▸ ADRA1A P35348 6/20 0.76
▸ OPRM1 P35372 6/20 0.76
▸ DRD3 P35462 6/20 0.76
▸ KCNH2 Q12809 6/20 0.76
▸ LMNA P02545 5/20 0.76
▸ ADRA2A P08913 5/20 0.76
▸ DRD1 P21728 5/20 0.76
▸ ALDH1A1 P00352 4/20 0.76
▸ SLC6A2 P23975 4/20 0.76
▸ SLC6A4 P31645 4/20 0.76
▸ PTGS1 P23219 4/20 0.76
▸ CYP1A2 P05177 4/20 0.76
▸ ALOX15 P16050 3/20 0.76
▸ HSD17B10 Q99714 3/20 0.76
▸ DRD2 P14416 3/20 0.76
▸ ADRA2B P18089 3/20 0.76

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
SCHEMBL10367779 0.92 CYP2D6 (0.76) CYP2D6CHRM2HTR1ACHRM1ADRA1A
Promethazine SCHEMBL4700 0.87 CYP2D6 (1.00) CYP2D6CHRM2HTR1ACHRM1ADRA1A
(S)-Promethazine SCHEMBL2900853 0.87 CYP2D6 (1.00) CYP2D6CHRM2HTR1ACHRM1ADRA1A
Promethazine SCHEMBL29372077 0.87 CYP2D6 (1.00) CYP2D6CHRM2HTR1ACHRM1ADRA1A
Promethazine SCHEMBL26777 0.87 CYP2D6 (1.00) CYP2D6CHRM2HTR1ACHRM1ADRA1A
Promethazine SCHEMBL2962420 0.86 LMNA (1.00) CYP2D6CHRM2HTR1ACHRM1ADRA1A
Promethazine SCHEMBL41904 0.86 LMNA (1.00) CYP2D6CHRM2HTR1ACHRM1ADRA1A
Promethazine SCHEMBL29390401 0.86 LMNA (1.00) CYP2D6CHRM2HTR1ACHRM1ADRA1A
Promethazine SCHEMBL5425141 0.86 LMNA (1.00) CYP2D6CHRM2HTR1ACHRM1ADRA1A
Promethazine SCHEMBL5501515 0.86 LMNA (1.00) CYP2D6CHRM2HTR1ACHRM1ADRA1A

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-0117302-B1 PHENOTHIAZINE DERIVATIVES THE WELLCOME FOUNDATION LIMITED (GB) 1990-06-27 — — EP disclosed
EP-0117302-A2 Phenothiazine derivatives THE WELLCOME FOUNDATION LIMITED (GB) 1984-09-05 — — EP disclosed
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