SCHEMBL9701745

SCHEMBL9701745

C[C](c1ccccc1)c1ccc(N(C)C)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.67
KMT2A Q03164 5/20 0.67
HPGD P15428 4/20 0.67
NPC1 O15118 3/20 0.67
MEN1 O00255 2/20 0.67
ALDH1A1 P00352 10/20 0.62
GFER P55789 1/20 0.62
MAPT P10636 7/20 0.52
TSHR P16473 3/20 0.50
MAPK1 P28482 3/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
ALOX15 P16050 2/20 0.50
HSD17B10 Q99714 2/20 0.50
CYP3A4 P08684 1/20 0.50
HBB P68871 1/20 0.50
KCNK3 O14649 1/20 0.50
KDM4E B2RXH2 1/20 0.50
LMNA P02545 2/20 0.49
GAA P10253 1/20 0.49
CASP3 P42574 1/20 0.49

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
SCHEMBL5339984 0.84 RAB9A (0.69) RAB9AKMT2AHPGDNPC1MEN1
SCHEMBL24851242 0.84 RAB9A (0.69) RAB9AKMT2AHPGDNPC1MEN1
SCHEMBL43585 0.80 HPGD (1.00) RAB9AKMT2AHPGDNPC1MEN1
Michler'S Ketone SCHEMBL3324670 0.80 HPGD (1.00) RAB9AKMT2AHPGDNPC1MEN1
SCHEMBL607222 0.80 KMT2A (1.00) RAB9AKMT2AHPGDNPC1MEN1
SCHEMBL10602674 0.80 TSHR (0.79) RAB9AKMT2AHPGDNPC1MEN1
SCHEMBL611876 0.80 RAB9A (0.64) RAB9AKMT2AHPGDNPC1MEN1
SCHEMBL4140401 0.80 RAB9A (1.00) RAB9AKMT2AHPGDNPC1MEN1
SCHEMBL27571830 0.80 RAB9A (0.64) RAB9AKMT2AHPGDNPC1MEN1
SCHEMBL28230346 0.80 HPGD (1.00) RAB9AKMT2AHPGDNPC1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5081191-A Functionalized polymers prepared by anionic polymerization THE DOW CHEMICAL COMPANY (US) 1992-01-14 US disclosed
US-4975491-A Functionalized polymers prepared by anionic polymerization THE DOW CHEMICAL COMPANY (US) 1990-12-04 US disclosed