SCHEMBL5614238

SCHEMBL5614238

c1ccc2nc3c(-c4nnn[nH]4)cccc3nc2c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 7/20 0.42
▸ RAB9A P51151 7/20 0.42
▸ MAPT P10636 5/20 0.42
▸ NPSR1 Q6W5P4 4/20 0.42
▸ GAA P10253 3/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ NQO2 P16083 5/20 0.39
▸ TP53 P04637 2/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ CCNT1 O60563 1/20 0.34
▸ CYP1A2 P05177 1/20 0.34
▸ CDK1 P06493 1/20 0.34
▸ CYP3A4 P08684 1/20 0.34
▸ CYP2C9 P11712 1/20 0.34
▸ CCNB1 P14635 1/20 0.34
▸ EIF2AK2 P19525 1/20 0.34
▸ CCNA2 P20248 1/20 0.34
▸ CCNE1 P24864 1/20 0.34
▸ CDK2 P24941 1/20 0.34
▸ CYP2C19 P33261 1/20 0.34

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
SCHEMBL12615990 0.78 ALDH1A1 (0.38) ALDH1A1GAAKMT2AMEN1L3MBTL1
SCHEMBL9590411 0.75 NPC1 (0.35) ALDH1A1RAB9AMAPTNPSR1GAA
SCHEMBL27969901 0.75 MAPT (0.60) ALDH1A1RAB9AMAPTNPSR1GAA
SCHEMBL22672663 0.74 — —
SCHEMBL1250423 0.74 KDM4E (0.42) ALDH1A1RAB9AMAPTGAATP53
SCHEMBL31494227 0.72 — —
SCHEMBL9590371 0.72 MGAM (0.40) ALDH1A1RAB9ANPSR1GAATP53
SCHEMBL28755087 0.70 NQO2 (0.42) ALDH1A1RAB9AMAPTNPSR1GAA
SCHEMBL7049117 0.70 ADORA2A (0.36) ALDH1A1RAB9AMAPTKMT2ACYP1A2
SCHEMBL8486043 0.70 — —

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
WO-2007037540-A1 CELLULOSE ACYLATE FILM, METHOD FOR PRODUCING SAME, OPTICALLY COMPENSATORY FILM, ANTI-REFLECTION FILM, POLARIZING PLATE AND IMAGE DISPLAY DEVICE FUJIFILM CORPORATION (JP) 2007-04-05 — — WO disclosed
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