SCHEMBL11072425

SCHEMBL11072425

OCON(OCO)c1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 2/20 0.37
TSHR P16473 2/20 0.36
ALDH1A1 P00352 5/20 0.35
KMT2A Q03164 4/20 0.35
NPC1 O15118 1/20 0.35
POLB P06746 1/20 0.35
HTT P42858 1/20 0.35
RAB9A P51151 1/20 0.35
GLA P06280 1/20 0.35
RECQL P46063 1/20 0.34
TDP1 Q9NUW8 2/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
ATM Q13315 1/20 0.34
MEN1 O00255 3/20 0.34
HPGD P15428 2/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
KDM4E B2RXH2 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2C9 P11712 1/20 0.32

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
SCHEMBL104212 0.81 ALDH1A1 (0.46) NPSR1TSHRALDH1A1KMT2ANPC1
Hydrochloric Acid SCHEMBL28957292 0.79 ALDH1A1 (0.45) NPSR1TSHRALDH1A1KMT2ANPC1
Ammonia Solution, Strong SCHEMBL28490309 0.79 ALDH1A1 (0.45) NPSR1TSHRALDH1A1KMT2ANPC1
SCHEMBL2575461 0.78 ALDH1A1 (0.39) NPSR1TSHRALDH1A1KMT2ANPC1
SCHEMBL2866524 0.76 ALDH1A1 (0.42) TSHRALDH1A1POLBHTTRAB9A
SCHEMBL1953867 0.75 ALDH1A1 (0.40) NPSR1TSHRALDH1A1KMT2ANPC1
Phosphoric Acid SCHEMBL1307714 0.73 ALDH1A1 (0.39) NPSR1TSHRALDH1A1KMT2AHTT
SCHEMBL4560055 0.71 TAAR1 (0.46) TSHRALDH1A1KMT2ARAB9ATDP1
SCHEMBL11575309 0.71 LMNA (0.39) TSHRALDH1A1KMT2AGLATDP1
Nitrogen SCHEMBL11192525 0.70 TSHR (0.36) NPSR1TSHRALDH1A1KMT2ANPC1

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
CN-105153905-B A kind of preparation method and applications of graphene modified polyurethane film forming agent 泰山玻璃纤维有限公司 2017-12-01 CN claimed
CN-105153905-B A kind of preparation method and applications of graphene modified polyurethane film forming agent 泰山玻璃纤维有限公司 2017-12-01 CN disclosed
US-4477635-A Polymeric triarylmethane dyes MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1984-10-16 US disclosed