SCHEMBL6367694

SCHEMBL6367694

CCCCCCC[C@H]1CC[C@H](CCC2CCC(c3ccc(Cc4ccc(N)cc4)cc3)(c3ccc(Cc4ccc(N)cc4)cc3)CC2)CC1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 14/20 0.40
ALDH1A1 P00352 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
GRM2 Q14416 1/20 0.35
CYP3A4 P08684 2/20 0.35
TSHR P16473 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
CYP2C8 P10632 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
S1PR3 Q99500 1/20 0.34
MAPT P10636 2/20 0.33
GAA P10253 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
SCHEMBL6417040 1.00 CYP19A1 (0.40) CYP19A1ALDH1A1L3MBTL1GRM2CYP3A4
SCHEMBL6362628 1.00 CYP19A1 (0.40) CYP19A1ALDH1A1L3MBTL1GRM2CYP3A4
SCHEMBL6363178 1.00 CYP19A1 (0.40) CYP19A1ALDH1A1L3MBTL1GRM2CYP3A4
SCHEMBL6367701 1.00 CYP19A1 (0.40) CYP19A1ALDH1A1L3MBTL1GRM2CYP3A4
SCHEMBL6367574 1.00 CYP19A1 (0.40) CYP19A1ALDH1A1L3MBTL1GRM2CYP3A4
SCHEMBL6417042 1.00 CYP19A1 (0.40) CYP19A1ALDH1A1L3MBTL1GRM2CYP3A4
SCHEMBL6363177 1.00 CYP19A1 (0.40) CYP19A1ALDH1A1L3MBTL1GRM2CYP3A4
SCHEMBL6367579 1.00 CYP19A1 (0.40) CYP19A1ALDH1A1L3MBTL1GRM2CYP3A4
SCHEMBL6751284 1.00 CYP19A1 (0.40) CYP19A1ALDH1A1L3MBTL1GRM2CYP3A4
SCHEMBL6363095 0.99 CYP19A1 (0.39) CYP19A1ALDH1A1L3MBTL1GRM2CYP3A4

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
US-6949281-B1 Varnish composition and liquid-crystal display element CHISSO CORPORATION (JP) 2005-09-27 US disclosed
US-6746730-B1 VARNISH COMPOSITION WHICH COMPRISES POLYMER COMPONENT CONTAINING TWO DIFFERENT POLYAMIC ACIDS, SOLUBLE POLYIMIDE, AND SOLVENT FOR DISSOLVING POLYMER COMPONENT CHISSO CORPORATION (JP) 2004-06-08 US disclosed
US-6685997-B1 SOLUTION CONTAINING POLYAMIC ACIDS, POLYAMIDES AND POLYIMIDES; ALIGNMENT FILM; WELL BALANCED ELECTRICAL CHARACTERISTICS; ELIMINATES IMAGE STICKING CHISSO CORPORATION (JP) 2004-02-03 US disclosed