SCHEMBL5596989

SCHEMBL5596989

Nc1ccc(-c2ccc(N)cc2-c2ccc(S(=O)(=O)O)cc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 5/20 0.64
▸ ALDH1A1 P00352 5/20 0.64
▸ NT5E P21589 2/20 0.64
▸ TDP1 Q9NUW8 3/20 0.47
▸ HSD17B10 Q99714 2/20 0.47
▸ CA1 P00915 6/20 0.46
▸ CA2 P00918 6/20 0.46
▸ CA12 O43570 5/20 0.46
▸ CA9 Q16790 5/20 0.46
▸ CA14 Q9ULX7 4/20 0.46
▸ NSD2 O96028 2/20 0.42
▸ DUSP3 P51452 1/20 0.42
▸ PTPN5 P54829 1/20 0.42
▸ CASP6 P55212 1/20 0.42
▸ PTPN11 Q06124 1/20 0.42
▸ LMNA P02545 3/20 0.42
▸ CYP3A4 P08684 2/20 0.42
▸ MPO P05164 1/20 0.42
▸ CYP2C9 P11712 1/20 0.42
▸ HTR6 P50406 1/20 0.42

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
SCHEMBL29756157 0.95 ALDH1A1 (0.61) TSHRALDH1A1NT5ETDP1HSD17B10
SCHEMBL21081959 0.95 ALDH1A1 (0.61) TSHRALDH1A1NT5ETDP1HSD17B10
SCHEMBL7572634 0.84 ALDH1A1 (0.57) TSHRALDH1A1NT5ETDP1HSD17B10
SCHEMBL11293217 0.83 LMNA (0.48) TSHRALDH1A1NT5ETDP1HSD17B10
SCHEMBL3612737 0.82 TSHR (0.86) TSHRALDH1A1NT5ETDP1HSD17B10
SCHEMBL30880329 0.80 ALDH1A1 (0.53) TSHRALDH1A1TDP1HSD17B10NSD2
SCHEMBL482994 0.80 TSHR (1.00) TSHRALDH1A1NT5ETDP1HSD17B10
SCHEMBL31415204 0.80 TSHR (1.00) TSHRALDH1A1NT5ETDP1HSD17B10
SCHEMBL24407 0.80 TSHR (1.00) TSHRALDH1A1NT5ETDP1HSD17B10
SCHEMBL14110641 0.80 ALDH1A1 (0.53) TSHRALDH1A1TDP1HSD17B10NSD2

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-109642388-B Surface-modified nanofiber, electrolyte membrane, method for producing electrolyte membrane, membrane electrode assembly, and solid polymer fuel cell 公立大学法人首都大学东京 2022-07-08 — — CN disclosed
JP-2007302743-A SULFONATED AROMATIC POLYIMIDE NIPPON STEEL CHEM CO LTD 2007-11-22 — — JP disclosed
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