SCHEMBL126404

SCHEMBL126404

O=C(O)c1cc[n+](-c2ccccc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 3/20 0.56
▸ DAO P14920 1/20 0.56
▸ NAPRT Q6XQN6 1/20 0.56
▸ SRD5A2 P31213 3/20 0.48
▸ CES2 O00748 1/20 0.48
▸ CES1 P23141 1/20 0.48
▸ TP53 P04637 1/20 0.48
▸ TRPA1 O75762 1/20 0.43
▸ CA1 P00915 3/20 0.41
▸ CA2 P00918 3/20 0.41
▸ CA12 O43570 1/20 0.41
▸ CA3 P07451 1/20 0.41
▸ TYR P14679 1/20 0.41
▸ DRD1 P21728 1/20 0.41
▸ CA4 P22748 1/20 0.41
▸ CA6 P23280 1/20 0.41
▸ CA5A P35218 1/20 0.41
▸ CA7 P43166 1/20 0.41
▸ CA9 Q16790 1/20 0.41
▸ CA14 Q9ULX7 1/20 0.41

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
SCHEMBL12905320 0.88 TSHR (0.48) TSHRDAONAPRTSRD5A2CES2
SCHEMBL25583322 0.84 ALDH1A1 (0.61) TSHRDAONAPRTSRD5A2CES2
SCHEMBL13343252 0.83 POLB (0.60) TSHRMEN1KMT2AALDH1A1
SCHEMBL29280085 0.82 TSHR (0.55) TSHRDAONAPRTSRD5A2CES2
Hydrochloric Acid SCHEMBL3530738 0.81 POLB (0.58) TSHRMEN1KMT2AALDH1A1
Hydrochloric Acid SCHEMBL8130912 0.81 POLB (0.58) TSHRMEN1KMT2AALDH1A1
SCHEMBL16433563 0.81 DHODH (0.46) TSHRDAONAPRTSRD5A2CES2
SCHEMBL15304782 0.80 TSHR (0.52) TSHRDAONAPRTSRD5A2CES2
Bromide SCHEMBL28109964 0.80 TSHR (0.52) TSHRDAONAPRTSRD5A2CES2
Hydrochloric Acid SCHEMBL23630251 0.75 KMT2A (0.53) TSHRDAONAPRTSRD5A2CES2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2143820-B1 An electroless gold plating solution ROHM & HAAS ELECT MAT (US) 2012-03-07 — — EP disclosed
EP-2143820-A1 An electroless gold plating solution Rohm and Haas Electronic Materials LLC (US) 2010-01-13 — — EP disclosed
US-7534289-B1 Electroless gold plating solution ROHM AND HAAS ELECTRONIC MATERIALS LLC (US) 2009-05-19 — — US disclosed
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