Aniline

Aniline

SCHEMBL11503542

NC(=O)/C=C\C(=O)O.NC(=O)/C=C\C(=O)O.Nc1ccccc1

nearest known ligand 0.48

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPSR1 Q6W5P4 1/20 0.48
▸ TSHR P16473 4/20 0.48
▸ HCAR2 Q8TDS4 2/20 0.45
▸ HDAC3 O15379 1/20 0.45
▸ TNKS O95271 1/20 0.45
▸ HDAC4 P56524 1/20 0.45
▸ HDAC1 Q13547 1/20 0.45
▸ HDAC7 Q8WUI4 1/20 0.45
▸ HDAC2 Q92769 1/20 0.45
▸ HDAC10 Q969S8 1/20 0.45
▸ HDAC11 Q96DB2 1/20 0.45
▸ HDAC8 Q9BY41 1/20 0.45
▸ TNKS2 Q9H2K2 1/20 0.45
▸ HDAC6 Q9UBN7 1/20 0.45
▸ HDAC9 Q9UKV0 1/20 0.45
▸ HDAC5 Q9UQL6 1/20 0.45
▸ CA1 P00915 1/20 0.44
▸ CA2 P00918 1/20 0.44
▸ NFKB1 P19838 1/20 0.44
▸ CA4 P22748 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
Fumaric Acid SCHEMBL21145252 0.91 TSHR (0.58) NPSR1TSHRHCAR2HDAC3TNKS
Fumaric Acid SCHEMBL21145251 0.91 TSHR (0.58) NPSR1TSHRHCAR2HDAC3TNKS
Maleic Acid SCHEMBL29876027 0.91 TSHR (0.58) NPSR1TSHRHCAR2HDAC3TNKS
Maleic Acid SCHEMBL28558115 0.89 TSHR (0.55) NPSR1TSHRHCAR2HDAC3TNKS
Maleic Acid SCHEMBL22325623 0.89 TSHR (0.55) NPSR1TSHRHCAR2HDAC3TNKS
Benzene SCHEMBL28859784 0.83 TSHR (0.56) NPSR1TSHRHCAR2HDAC3TNKS
Phenol SCHEMBL28258965 0.83 MAPT (0.50) TSHRHCAR2HDAC3TNKSHDAC4
(Z)-1,2-Diphenylethene SCHEMBL23274057 0.81 HDAC1 (0.65) NPSR1TSHRHCAR2HDAC3TNKS
(Z)-1,2-Diphenylethene SCHEMBL23274056 0.81 HDAC1 (0.65) NPSR1TSHRHCAR2HDAC3TNKS
Benzoic Acid SCHEMBL27748879 0.81 TSHR (0.58) TSHRHCAR2HDAC3TNKSHDAC4

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
EP-0001666-A2 Imide-crosslinked ethylenic polymer resin foams and method of making THE DOW CHEMICAL COMPANY (US) 1979-05-02 — — EP disclosed
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