SCHEMBL8944343

SCHEMBL8944343

COc1ccc(Nc2cccc(OCc3cccc(COc4cccc(Nc5ccc(C)cc5)c4Nc4ccc(C)cc4)c3)c2Nc2ccc(OC)cc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.46
MAOB P27338 2/20 0.43
RAB9A P51151 3/20 0.42
ABCB1 P08183 3/20 0.41
HTR1A P08908 1/20 0.41
DRD2 P14416 1/20 0.41
AKR1C3 P42330 1/20 0.41
AKR1C2 P52895 1/20 0.41
CTSV O60911 1/20 0.41
CTSL P07711 1/20 0.41
ACP1 P24666 1/20 0.41
MAPT P10636 3/20 0.40
LMNA P02545 3/20 0.40
GAA P10253 2/20 0.40
KDM4E B2RXH2 2/20 0.40
SGMS2 Q8NHU3 1/20 0.40
MEN1 O00255 1/20 0.40
THRB P10828 1/20 0.40
HTT P42858 1/20 0.40
RECQL P46063 1/20 0.40

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
SCHEMBL8943593 0.95 ALDH1A1 (0.47) ALDH1A1MAOBRAB9AABCB1HTR1A
SCHEMBL8943788 0.93 SGMS2 (0.41) ALDH1A1MAOBRAB9AHTR1ACTSV
SCHEMBL8943973 0.87 ALDH1A1 (0.49) ALDH1A1MAOBRAB9AABCB1HTR1A
SCHEMBL8943993 0.86 ALDH1A1 (0.51) ALDH1A1RAB9AAKR1C3AKR1C2ACP1
SCHEMBL8944054 0.85 HTR1A (0.44) ALDH1A1MAOBRAB9AHTR1ACTSV
SCHEMBL8944340 0.84 CTSV (0.44) ALDH1A1MAOBRAB9AAKR1C3AKR1C2
SCHEMBL8943983 0.81 ALDH1A1 (0.44) ALDH1A1RAB9AAKR1C3AKR1C2ACP1
SCHEMBL8944281 0.81 ALDH1A1 (0.53) ALDH1A1RAB9AMAPTGAAKDM4E
SCHEMBL8943587 0.81 ALDH1A1 (0.53) ALDH1A1RAB9AMAPTLMNAGAA
SCHEMBL8943887 0.79 ALDH1A1 (0.51) ALDH1A1RAB9AMAPTGAAKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5480765-A PRESSURE AND HEAT SENSITIVE PAPER, IMPROVED PHOTOSTABILITY BY ADDITION OF TRIARYLAMINE COMPOUND FUJI PHOTO FILM CO., LTD. (JP) 1996-01-02 US disclosed