SCHEMBL9755467

SCHEMBL9755467

O=C(Nc1ccc2ccc3cccnc3c2n1)c1ccc(Cl)cc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 4/20 0.69
KDR P35968 4/20 0.69
GAA P10253 1/20 0.69
NPC1 O15118 2/20 0.62
RAB9A P51151 2/20 0.62
RXFP1 Q9HBX9 1/20 0.59
KMT2A Q03164 6/20 0.55
MEN1 O00255 4/20 0.55
TDP1 Q9NUW8 2/20 0.53
PPARG P37231 1/20 0.53
NR2E3 Q9Y5X4 1/20 0.53
NCOR2 Q9Y618 1/20 0.53
HDAC6 Q9UBN7 1/20 0.52
TP53 P04637 1/20 0.51
MAPT P10636 1/20 0.51
SMN1; SMN2 Q16637 2/20 0.50
PABPC1 P11940 1/20 0.50
EIF4H Q15056 1/20 0.50
ADORA3 P0DMS8 1/20 0.49
EGLN1 Q9GZT9 1/20 0.49

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
SCHEMBL9755469 0.89 KDR (0.65) L3MBTL1KDRGAANPC1RAB9A
SCHEMBL24733628 0.88 RAB9A (0.63) L3MBTL1KDRGAANPC1RAB9A
SCHEMBL9755453 0.84 KMT2A (0.63) L3MBTL1NPC1RAB9AKMT2AMEN1
SCHEMBL30061444 0.82 KDR (1.00) L3MBTL1KDRGAANPC1RAB9A
SCHEMBL11973049 0.82 KDR (1.00) L3MBTL1KDRGAANPC1RAB9A
SCHEMBL2570298 0.77 KMT2A (0.70) KDRNPC1RAB9ARXFP1KMT2A
SCHEMBL12204397 0.77 NPC1 (1.00) NPC1RAB9ARXFP1KMT2AMEN1
SCHEMBL12156118 0.75 L3MBTL1 (0.49) L3MBTL1KDRGAANPC1RAB9A
SCHEMBL12156126 0.75 L3MBTL1 (0.48) L3MBTL1KDRGAANPC1RAB9A
Phenanthroline SCHEMBL28825890 0.74 MAP4K4 (0.54) L3MBTL1KDRGAAKMT2AMEN1

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-1991005785-A1 1,10-PHENANTHROLINE DERIVATIVES VERENIGING VOOR CHRISTELIJK WETENSCHAPPELIJK ONDERWIJS (NL) 1991-05-02 WO disclosed