SCHEMBL7474010

SCHEMBL7474010

O=C(O)c1ccccc1-c1nnco1

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.57
NOTUM Q6P988 7/20 0.56
ALDH1A1 P00352 2/20 0.45
ALOX15 P16050 1/20 0.45
PDK2 Q15119 1/20 0.44
TSHR P16473 3/20 0.44
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
TP53 P04637 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
KDM4E B2RXH2 1/20 0.44
USP2 O75604 1/20 0.44
TLR8 Q9NR97 1/20 0.44
MYC P01106 1/20 0.43
GAA P10253 1/20 0.42

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
SCHEMBL27874781 0.86 NOTUM (0.53) KMT2ANOTUMALDH1A1PDK2TSHR
SCHEMBL11568268 0.86 NOTUM (0.57) KMT2ANOTUMALDH1A1ALOX15PDK2
SCHEMBL30655822 0.86 NOTUM (0.53) KMT2ANOTUMALDH1A1PDK2TSHR
SCHEMBL29032338 0.85 KMT2A (0.50) KMT2ANOTUMALDH1A1PDK2TSHR
SCHEMBL32674532 0.77 EGFR (0.52) KMT2AALDH1A1ALOX15TSHRNPC1
SCHEMBL11341017 0.77 EGFR (0.52) KMT2AALDH1A1ALOX15TSHRNPC1
SCHEMBL4276979 0.76 NOTUM (0.70) KMT2ANOTUMTSHRNPC1RAB9A
SCHEMBL21061962 0.76 NOTUM (0.61) KMT2ANOTUMPDK2TSHRNPC1
SCHEMBL10860231 0.75 KDM4E (0.62) KMT2ANOTUMALDH1A1ALOX15TSHR
SCHEMBL29204217 0.74 KMT2A (0.50) KMT2ANOTUMALDH1A1PDK2TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4265804-A BENZOXAZOYLBENZOATES, OXADIAZOLE-2,5-DIBENZOATES, BENZOTRIAZOLES AND BENZOTRIAZOTRIAZOLES EASTMAN KODAK COMPANY (US) 1981-05-05 US claimed
EP-1173472-A1 CYCLIC HEXAPEPTIDES HAVING ANTIBIOTIC ACTIVITY FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-01-23 EP disclosed
WO-2000064927-A1 CYCLIC HEXAPEPTIDES HAVING ANTIBIOTIC ACTIVITY FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-11-02 WO disclosed
US-4265804-A BENZOXAZOYLBENZOATES, OXADIAZOLE-2,5-DIBENZOATES, BENZOTRIAZOLES AND BENZOTRIAZOTRIAZOLES EASTMAN KODAK COMPANY (US) 1981-05-05 US disclosed
US-4120861-A PLANT GROWTH REGULATORS UNIROYAL, INC. (US) 1978-10-17 US disclosed
US-4035175-A SOYBEANS, COTTON UNIROYAL INC. (US) 1977-07-12 US disclosed
US-3964896-A Oxadiazole benzoic acid derivatives as herbicides UNIROYAL, INC. (US) 1976-06-22 US disclosed
US-3947263-A OXADIAZOLE OR THIADIAZOLE SUBSTITUTED BENZOIC ACID UNIROYAL, INC. (US) 1976-03-30 US disclosed