SCHEMBL1276497

SCHEMBL1276497

c1ccc(N(c2ccccn2)c2ccccc2-c2ccccc2N(c2ccccn2)c2ccccn2)nc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP2D6 P10635 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41
▸ KDM4E B2RXH2 2/20 0.37
▸ LMNA P02545 2/20 0.37
▸ CYP1A2 P05177 1/20 0.37
▸ POLB P06746 1/20 0.37
▸ CCR1 P32246 1/20 0.37
▸ CCR5 P51681 1/20 0.37
▸ CCR8 P51685 1/20 0.37
▸ METAP1 P53582 1/20 0.37
▸ BLM P54132 1/20 0.37
▸ HIF1A Q16665 1/20 0.37
▸ DOHH Q9BU89 1/20 0.37
▸ P4HTM Q9NXG6 1/20 0.37
▸ MAOA P21397 1/20 0.36
▸ MAOB P27338 1/20 0.36
▸ NPC1 O15118 3/20 0.35
▸ RAB9A P51151 3/20 0.35
▸ KMT2A Q03164 3/20 0.35
▸ ALDH1A1 P00352 3/20 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
SCHEMBL3973446 0.88 CHRNB2 (0.37) CYP2D6CYP2C19KDM4ELMNAMAOA
SCHEMBL17713826 0.88 KDM4E (0.46) CYP2D6CYP2C19KDM4ELMNACYP1A2
SCHEMBL2289138 0.81 CYP2D6 (0.50) CYP2D6CYP2C19KDM4ELMNACYP1A2
SCHEMBL427325 0.80 ALDH1A1 (0.36) CYP2D6CYP2C19KDM4ELMNAMAOA
SCHEMBL8202219 0.79 CYP2D6 (0.48) CYP2D6CYP2C19KDM4ELMNACYP1A2
SCHEMBL28556315 0.78 NOS3 (0.40) CYP2D6CYP2C19KDM4ELMNACYP1A2
SCHEMBL13230733 0.77 MEN1 (0.32) LMNAKMT2AMEN1
SCHEMBL19240177 0.77 TDP1 (0.37) LMNANPC1RAB9AKCNH2TDP1
SCHEMBL11969448 0.76 CYP2D6 (0.37) CYP2D6CYP2C19KDM4ELMNACYP1A2
SCHEMBL13511252 0.76 CYP2D6 (0.42) CYP2D6CYP2C19KDM4ELMNACYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1052661-B1 Metal complex dye for a photoelectrochemical cell FUJIFILM CORP (JP) 2011-11-02 — — EP disclosed
EP-2280404-A2 Metal complex dye for a photoelectrochemical cell FUJIFILM Corporation (JP) 2011-02-02 — — EP disclosed
EP-1052661-A2 Metal complex dye for a photoelectrochemical cell FUJI PHOTO FILM CO., LTD. (JP) 2000-11-15 — — EP disclosed
EP-1049117-A2 Metal complex dye for a photoelectrochemical cell Fuji Photo Film Co., Ltd. (JP) 2000-11-02 — — EP disclosed
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