SCHEMBL10492737

SCHEMBL10492737

Cc1cc(C(C)c2ccc(Cl)cc2)c(N)cc1N

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 5/20 0.46
▸ ADRB2 P07550 1/20 0.42
▸ MEN1 O00255 1/20 0.41
▸ NPC1 O15118 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ ATM Q13315 1/20 0.41
▸ S1PR1 P21453 1/20 0.38
▸ S1PR3 Q99500 1/20 0.38
▸ TSHR P16473 6/20 0.34
▸ MAPK1 P28482 2/20 0.34
▸ TP53 P04637 2/20 0.34
▸ LMNA P02545 1/20 0.34
▸ HTT P42858 1/20 0.34
▸ POLB P06746 1/20 0.34
▸ GAA P10253 1/20 0.34
▸ GFER P55789 1/20 0.34
▸ IDO1 P14902 2/20 0.34
▸ TDO2 P48775 2/20 0.34
▸ ALDH1A1 P00352 4/20 0.33
▸ ALOX15 P16050 2/20 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
SCHEMBL10492513 0.82 TYR (0.43) CYP3A4KMT2ATSHRMAPK1LMNA
SCHEMBL10492808 0.80 MEN1 (0.43) CYP3A4MEN1NPC1KMT2AATM
SCHEMBL10492741 0.77 ADRB2 (0.44) CYP3A4ADRB2MEN1NPC1KMT2A
SCHEMBL10492514 0.76 TDP1 (0.38) CYP3A4NPC1ATMMAPK1TP53
SCHEMBL9404367 0.75 CASP1 (0.38) CYP3A4MEN1NPC1KMT2ATSHR
SCHEMBL7914810 0.73 ADRB2 (0.47) CYP3A4ADRB2ATMTSHRMAPK1
SCHEMBL23685775 0.71 L3MBTL1 (0.42) CYP3A4ADRB2MEN1NPC1KMT2A
SCHEMBL169738 0.71 POLB (0.53) CYP3A4MEN1NPC1KMT2ATSHR
SCHEMBL3238327 0.70 L3MBTL1 (0.49) CYP3A4MEN1NPC1KMT2AATM
Methylamine SCHEMBL6499701 0.70 ADRB2 (0.64) ADRB2TSHRMAPK1TP53LMNA

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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