SCHEMBL8788407

SCHEMBL8788407

O=C(Nc1ccncc1)ON1c2ccccc2Sc2ccccc21

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.49
▸ BCHE P06276 6/20 0.48
▸ TAAR1 Q96RJ0 1/20 0.44
▸ MAPT P10636 2/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ JAK2 O60674 1/20 0.42
▸ TYK2 P29597 1/20 0.42
▸ HTT P42858 2/20 0.41
▸ MDM2 Q00987 1/20 0.41
▸ NOX1 Q9Y5S8 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ LMNA P02545 1/20 0.40
▸ ALOX12 P18054 1/20 0.40
▸ NPSR1 Q6W5P4 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
SCHEMBL8426655 0.78 BCHE (0.77) BCHEMAPTMEN1KMT2AHTT
SCHEMBL8788369 0.71 BCHE (0.53) BCHEMEN1KMT2ANOX1LMNA
SCHEMBL7127793 0.67 BCHE (0.49) BCHEKMT2ANOX1LMNA
SCHEMBL589501 0.66 ALDH1A1 (0.65) POLBTAAR1MAPTMEN1KMT2A
SCHEMBL1616693 0.66 MDM2 (0.61) POLBBCHETAAR1MAPTMEN1
SCHEMBL13679756 0.66 POLB (1.00) POLBBCHETAAR1MAPTSMN1; SMN2
SCHEMBL2656818 0.65 BCHE (0.63) BCHENOX1LMNA
SCHEMBL8809142 0.65 HDAC6 (0.49) POLBBCHEMEN1KMT2AHTT
SCHEMBL1616690 0.65 MDM2 (0.59) POLBBCHETAAR1MEN1KMT2A
SCHEMBL28109662 0.64 MDM2 (0.44) POLBBCHETAAR1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0777481-A1 USE OF N-SUBSTITUTED PHENOTHIAZINES BAYER AG (DE) 1997-06-11 — — EP claimed
WO-1996005837-A1 USE OF N-SUBSTITUTED PHENOTHIAZINES BAYER AKTIENGESELLSCHAFT (DE) 1996-02-29 — — WO claimed
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