SCHEMBL7787022

SCHEMBL7787022

Cc1ccc(-c2ccc(N(c3ccc(N)cc3)c3ccc(N)cc3)cc2)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 2/20 0.59
TDP1 Q9NUW8 7/20 0.54
ALDH1A1 P00352 7/20 0.54
MAPT P10636 7/20 0.54
CYP3A4 P08684 5/20 0.54
L3MBTL1 Q9Y468 4/20 0.54
KDM4E B2RXH2 3/20 0.54
CYP1A2 P05177 1/20 0.54
CYP2D6 P10635 1/20 0.54
CYP2C9 P11712 1/20 0.54
CYP2C19 P33261 1/20 0.54
TP53 P04637 4/20 0.50
TSHR P16473 3/20 0.46
MAPK1 P28482 2/20 0.46
TEAD4 Q15561 1/20 0.46
PSMD14 O00487 1/20 0.46
RECQL P46063 1/20 0.46
GFER P55789 1/20 0.46
ALOX15 P16050 1/20 0.46
POLB P06746 1/20 0.45

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
SCHEMBL7010398 1.00 ACHE (0.59) ACHETDP1ALDH1A1MAPTCYP3A4
SCHEMBL9841016 1.00 ACHE (0.59) ACHETDP1ALDH1A1MAPTCYP3A4
SCHEMBL4832743 1.00 ACHE (0.59) ACHETDP1ALDH1A1MAPTCYP3A4
SCHEMBL7011963 1.00 ACHE (0.59) ACHETDP1ALDH1A1MAPTCYP3A4
SCHEMBL13926343 1.00 ACHE (0.59) ACHETDP1ALDH1A1MAPTCYP3A4
SCHEMBL12814483 1.00 ACHE (0.59) ACHETDP1ALDH1A1MAPTCYP3A4
SCHEMBL14160923 0.93 ACHE (0.68) ACHETDP1ALDH1A1MAPTCYP3A4
SCHEMBL13926340 0.93 ACHE (0.68) ACHETDP1ALDH1A1MAPTCYP3A4
SCHEMBL1457605 0.93 ACHE (0.68) ACHETDP1ALDH1A1MAPTCYP3A4
SCHEMBL24255048 0.92 ALDH1A1 (0.69) ACHETDP1ALDH1A1MAPTCYP3A4

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
EP-0805143-B1 ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC THIN FILM, AND TRIAMINE COMPOUNDS IDEMITSU KOSAN CO (JP) 2001-12-05 EP disclosed
US-6074734-A Organic electroluminescence device, organic thin film, and triamine compound IDEMITSU KOSAN CO., LTD. (JP) 2000-06-13 US disclosed
EP-0805143-A1 ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC THIN FILM, AND TRIAMINE COMPOUNDS IDEMITSU KOSAN COMPANY LIMITED (JP) 1997-11-05 EP disclosed