Pyridine

Pyridine

SCHEMBL27976938

COc1ccc(Cn2ccc3ccccc32)cc1.c1ccncc1

nearest known ligand 0.67

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTR6 P50406 2/20 0.55
▸ KMT2A Q03164 2/20 0.52
▸ SMPD1 P17405 1/20 0.50
▸ CYP11B1 P15538 1/20 0.50
▸ CYP11B2 P19099 1/20 0.50
▸ HDAC8 Q9BY41 4/20 0.49
▸ HDAC6 Q9UBN7 3/20 0.49
▸ HDAC11 Q96DB2 2/20 0.49
▸ HDAC1 Q13547 2/20 0.49
▸ HDAC2 Q92769 2/20 0.49
▸ HDAC10 Q969S8 2/20 0.49
▸ HDAC9 Q9UKV0 2/20 0.49
▸ HDAC3 O15379 1/20 0.49
▸ HDAC4 P56524 1/20 0.49
▸ HDAC7 Q8WUI4 1/20 0.49
▸ HDAC5 Q9UQL6 1/20 0.49
▸ NCOR2 Q9Y618 1/20 0.49
▸ PLAU P00749 1/20 0.49
▸ ALDH1A1 P00352 3/20 0.46
▸ SMN1; SMN2 Q16637 3/20 0.46

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
SCHEMBL30914586 0.90 HTR6 (0.66) HTR6KMT2ASMPD1HDAC8HDAC6
SCHEMBL6086778 0.90 HTR6 (0.66) HTR6KMT2ASMPD1HDAC8HDAC6
Thiophene SCHEMBL27976624 0.82 HTR6 (0.56) HTR6KMT2ASMPD1HDAC8HDAC6
SCHEMBL3177815 0.81 HTR6 (0.65) HTR6KMT2AHDAC8HDAC6HDAC1
SCHEMBL28886142 0.77 HTR2A (0.57) HTR6KMT2AHDAC8HDAC6HDAC11
SCHEMBL29509279 0.77 HTR6 (0.73) HTR6KMT2AHDAC8HDAC6HDAC1
SCHEMBL31021 0.77 HTR6 (0.73) HTR6KMT2AHDAC8HDAC6HDAC1
Acrylamide SCHEMBL27983435 0.77 PLAU (0.54) HTR6KMT2ASMPD1HDAC8HDAC6
SCHEMBL27976942 0.76 PDE5A (0.59) HTR6HDAC8HDAC6HDAC11HDAC1
SCHEMBL6192092 0.76 HTR6 (0.59) HTR6KMT2AHDAC8HDAC6HDAC1

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
CN-104130175-A Different-position substituted indolone derivatives and application thereof UNIV TIANJIN SCIENCE & TECH 2014-11-05 — — CN claimed
CN-104130175-A Different-position substituted indolone derivatives and application thereof UNIV TIANJIN SCIENCE & TECH 2014-11-05 — — CN disclosed
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