SCHEMBL11322241

SCHEMBL11322241

O=C(NC(=S)NCCSCc1cccnn1)c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.56
ALDH1A1 P00352 7/20 0.54
ALOX12 P18054 3/20 0.50
LMNA P02545 4/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
KDM4E B2RXH2 1/20 0.47
MITF O75030 1/20 0.46
HPGD P15428 1/20 0.44
GAA P10253 2/20 0.42
ALPL P05186 1/20 0.42
ALPI P09923 1/20 0.42
ALPG P10696 1/20 0.42
CYP2C9 P11712 1/20 0.42
MEN1 O00255 1/20 0.42
RECQL P46063 1/20 0.42
KMT2A Q03164 1/20 0.42
MAPT P10636 1/20 0.41
EPHX1 P07099 1/20 0.41

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
SCHEMBL11329904 0.81 RAB9A (0.60) RAB9AALDH1A1ALOX12LMNASMN1; SMN2
SCHEMBL11310931 0.81 ALDH1A1 (0.58) RAB9AALDH1A1ALOX12LMNASMN1; SMN2
SCHEMBL11323918 0.81 ALDH1A1 (0.51) RAB9AALDH1A1ALOX12LMNASMN1; SMN2
SCHEMBL11323934 0.81 ALDH1A1 (0.51) RAB9AALDH1A1ALOX12LMNASMN1; SMN2
SCHEMBL11317519 0.80 ALDH1A1 (0.50) RAB9AALDH1A1ALOX12LMNASMN1; SMN2
SCHEMBL11311421 0.79 SMN1; SMN2 (0.40) ALDH1A1ALOX12LMNASMN1; SMN2KDM4E
SCHEMBL10852410 0.79 RAB9A (0.52) RAB9AALDH1A1ALOX12LMNASMN1; SMN2
SCHEMBL11327195 0.76 CYP1A2 (0.36) ALDH1A1ALOX12LMNASMN1; SMN2HPGD
SCHEMBL11310490 0.76 RAB9A (0.52) RAB9AALDH1A1ALOX12LMNASMN1; SMN2
SCHEMBL11386306 0.76 ALDH1A1 (0.53) RAB9AALDH1A1ALOX12LMNASMN1; 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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4307101-A ANTIHISTAMINES AND ANTISECRETORY AGENTS OF THE THIOUREA OR UREA DERIVATIVES 5,6,7,8-TETRAHYDROIMIDAZO(1,5A)PYRIDINE SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1981-12-22 US disclosed
US-4293697-A ANTIHISTAMINES SMITH, KLINE & FRENCH LABORATORIES LIMITED (GB) 1981-10-06 US disclosed
US-4230865-A ANTIHISTAMINES SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1980-10-28 US disclosed
US-4226874-A ANTIHISTAMINES, ANTISECRETORY AGENTS, GASTRIC JUICE SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1980-10-07 US disclosed
US-4151288-A ANTHISTAMINES SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1979-04-24 US disclosed
US-4018931-A INHIBITION OF H-2 HISTAMINE RECEPTORS SMITH KLINE & FRENCH LABORATORIES LIMITED (EN) 1977-04-19 US disclosed
US-3950353-A HISTAMINE INHIBITORS SMITH KLINE & FRENCH LABORATORIES LIMITED (EN) 1976-04-13 US disclosed