SCHEMBL10492514

SCHEMBL10492514

Cc1ccc(C(C)c2cc(C(C)c3ccc(C)cc3)c(N)cc2N)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 3/20 0.38
▸ ALOX15 P16050 3/20 0.38
▸ CYP3A4 P08684 2/20 0.38
▸ TP53 P04637 1/20 0.38
▸ THRB P10828 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ ACHE P22303 3/20 0.37
▸ ALDH1A1 P00352 5/20 0.37
▸ CHRNA7 P36544 1/20 0.35
▸ GAA P10253 2/20 0.35
▸ ALOX12 P18054 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ HIF1A Q16665 1/20 0.35
▸ ALOX5 P09917 1/20 0.35
▸ HSD17B10 Q99714 2/20 0.34
▸ CA1 P00915 1/20 0.33
▸ ESR1 P03372 1/20 0.33
▸ PDCD1 Q15116 1/20 0.33
▸ ESR2 Q92731 1/20 0.33
▸ CD274 Q9NZQ7 1/20 0.33

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
SCHEMBL10492742 0.82 ACHE (0.43) TDP1ALOX15CYP3A4TP53THRB
SCHEMBL10492576 0.81 TYR (0.48) ALDH1A1HIF1ALMNATYR
SCHEMBL10492737 0.76 CYP3A4 (0.46) TDP1ALOX15CYP3A4TP53SMN1; SMN2
SCHEMBL27498391 0.75 ALDH1A1 (0.43) TDP1ALOX15CYP3A4TP53THRB
SCHEMBL10389943 0.75 TDP1 (0.43) TDP1ALOX15CYP3A4TP53THRB
SCHEMBL28680565 0.75 CD44 (0.42) TDP1ALOX15CYP3A4TP53THRB
SCHEMBL10492513 0.75 TYR (0.43) TDP1ALOX15CYP3A4ALDH1A1GAA
SCHEMBL146509 0.74 ESR1 (0.55) TDP1ACHEALDH1A1CHRNA7GAA
SCHEMBL10492808 0.73 MEN1 (0.43) TDP1ALOX15CYP3A4SMN1; SMN2ALDH1A1
SCHEMBL20132340 0.73 ACHE (0.65) TDP1CYP3A4TP53SMN1; SMN2ACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4868225-A STERICALLY HINDERED META-PHENYLENEDIAMINE CHAIN EXTENDER FOR POLYURETHANES THE DOW CHEMICAL COMPANY (US) 1989-09-19 — — US disclosed
US-4866208-A CURING AGENT FOR EPOXY RESINS; EXTENDERS FOR POLYUREA-URETHANE COPOLYMERS THE DOW CHEMICAL COMPANY (US) 1989-09-12 — — US disclosed
US-4792623-A CURING AGENT, EXTENDER THE DOW CHEMICAL COMPANY (US) 1988-12-20 — — US disclosed
EP-0082258-B1 SUBSTITUTED M-PHENYLENEDIAMINES THE DOW CHEMICAL COMPANY (US) 1986-02-19 — — EP disclosed
EP-0082258-A1 Substituted m-phenylenediamines THE DOW CHEMICAL COMPANY (US) 1983-06-29 — — EP disclosed
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