SCHEMBL4912911

SCHEMBL4912911

C(=N/c1ccc(/N=C/c2c3ccccc3cc3ccccc23)cc1)\c1c2ccccc2cc2ccccc12

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 10/20 0.57
▸ MAPT P10636 9/20 0.57
▸ MEN1 O00255 7/20 0.57
▸ POLB P06746 4/20 0.57
▸ GAA P10253 3/20 0.57
▸ KDM4E B2RXH2 3/20 0.57
▸ THRB P10828 1/20 0.57
▸ BLM P54132 1/20 0.57
▸ CASP6 P55212 1/20 0.57
▸ L3MBTL1 Q9Y468 1/20 0.57
▸ AMY1A P0DUB6 1/20 0.53
▸ ALDH1A1 P00352 5/20 0.50
▸ LMNA P02545 4/20 0.50
▸ TDP1 Q9NUW8 2/20 0.50
▸ HKDC1 Q2TB90 1/20 0.50
▸ HTT P42858 5/20 0.49
▸ NPSR1 Q6W5P4 1/20 0.49
▸ PLEC Q15149 1/20 0.46
▸ HPGD P15428 2/20 0.44
▸ MAOB P27338 1/20 0.44

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
SCHEMBL4912916 1.00 KMT2A (0.57) KMT2AMAPTMEN1POLBGAA
SCHEMBL12416949 0.85 CA2 (0.62) ALDH1A1
SCHEMBL3917470 0.81 KMT2A (0.67) KMT2AMAPTMEN1POLBGAA
SCHEMBL3917467 0.81 KMT2A (0.67) KMT2AMAPTMEN1POLBGAA
SCHEMBL4922100 0.80 KMT2A (0.51) KMT2AMAPTMEN1POLBGAA
SCHEMBL28985920 0.79 KMT2A (0.51) KMT2AMAPTMEN1POLBGAA
SCHEMBL10623179 0.78 AMY1A (0.56) KMT2AMAPTMEN1POLBGAA
SCHEMBL16476564 0.78 AMY1A (0.56) KMT2AMAPTMEN1POLBGAA
SCHEMBL18873292 0.78 AMY1A (0.56) KMT2AMAPTMEN1POLBGAA
SCHEMBL28985919 0.78 KMT2A (0.57) KMT2AMAPTMEN1POLBGAA

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-20080146772-A1 MATERIALS AND METHODS FOR CO-CRYSTAL CONTROLLED SOLID-STATE SYNTHESIS OF IMIDES AND IMINES UNIVERSITY OF SOUTH FLORIDA (US) 2008-06-19 — — US disclosed
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