SCHEMBL7903705

SCHEMBL7903705

Cc1ccccc1N(c1ccc(-c2ccc(N(c3ccccc3)c3ccc(N)cc3)cc2)cc1)c1ccccc1C

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.60
CYP3A4 P08684 5/20 0.60
TDP1 Q9NUW8 5/20 0.60
MAPT P10636 3/20 0.60
L3MBTL1 Q9Y468 3/20 0.60
KDM4E B2RXH2 3/20 0.60
CYP1A2 P05177 1/20 0.60
CYP2D6 P10635 1/20 0.60
CYP2C9 P11712 1/20 0.60
CYP2C19 P33261 1/20 0.60
HSD17B10 Q99714 2/20 0.45
TAAR1 Q96RJ0 1/20 0.45
TP53 P04637 2/20 0.37
MAPK1 P28482 2/20 0.36
TSHR P16473 2/20 0.36
PSMD14 O00487 1/20 0.36
RECQL P46063 1/20 0.36
GFER P55789 1/20 0.36
ALOX15 P16050 2/20 0.35
NPC1 O15118 2/20 0.35

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
SCHEMBL7004541 0.97 ALDH1A1 (0.60) ALDH1A1CYP3A4TDP1MAPTL3MBTL1
SCHEMBL7010403 0.93 ALDH1A1 (0.48) ALDH1A1CYP3A4TDP1MAPTL3MBTL1
SCHEMBL7011968 0.91 ALDH1A1 (0.50) ALDH1A1CYP3A4TDP1MAPTL3MBTL1
SCHEMBL1153906 0.91 CYP3A4 (0.43) ALDH1A1CYP3A4TDP1MAPTL3MBTL1
SCHEMBL185396 0.91 CYP3A4 (0.43) ALDH1A1CYP3A4TDP1MAPTL3MBTL1
SCHEMBL7009409 0.90 CYP3A4 (0.59) ALDH1A1CYP3A4TDP1MAPTL3MBTL1
SCHEMBL6928517 0.90 CYP3A4 (0.63) ALDH1A1CYP3A4TDP1MAPTL3MBTL1
SCHEMBL5706260 0.89 CYP3A4 (0.56) ALDH1A1CYP3A4TDP1MAPTL3MBTL1
SCHEMBL16324036 0.88 CYP3A4 (0.43) ALDH1A1CYP3A4TDP1MAPTL3MBTL1
SCHEMBL19102572 0.88 CYP3A4 (0.43) ALDH1A1CYP3A4TDP1MAPTL3MBTL1

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-6203154-B1 MULTILAYER NIPPON MITSUBISHI OIL CORPORATION (JP) 2001-03-20 US disclosed
EP-1041425-A1 ELECTROCHROMIC ELEMENT Nippon Mitsubishi Oil Corporation (JP) 2000-10-04 EP disclosed