SCHEMBL9575702

SCHEMBL9575702

c1ccc([In]c2ccccc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.40
ALOX15 P16050 1/20 0.37
TSHR P16473 4/20 0.35
TDP1 Q9NUW8 4/20 0.35
CA1 P00915 2/20 0.35
CA2 P00918 2/20 0.35
CA9 Q16790 2/20 0.35
ALOX12 P18054 2/20 0.35
CA12 O43570 1/20 0.35
GLA P06280 1/20 0.35
CA3 P07451 1/20 0.35
CA4 P22748 1/20 0.35
CA14 Q9ULX7 1/20 0.35
LMNA P02545 1/20 0.35
ACHE P22303 1/20 0.35
CA7 P43166 1/20 0.35
HSD17B10 Q99714 2/20 0.33
CYP2A6 P11509 1/20 0.33
MAPT P10636 1/20 0.33
HPGD P15428 1/20 0.33

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
SCHEMBL15847173 0.96 ALDH1A1 (0.38) ALDH1A1ALOX15TSHRTDP1CA1
Hydrochloric Acid SCHEMBL7791639 0.96 ALDH1A1 (0.38) ALDH1A1ALOX15TSHRTDP1CA1
Fluoride SCHEMBL943616 0.67 ALDH1A1 (0.40) ALDH1A1TSHRTDP1CA1CA2
Fluoride SCHEMBL915048 0.67 ALDH1A1 (0.40) ALDH1A1TSHRTDP1CA1CA2
Fluoride SCHEMBL943618 0.67 ALDH1A1 (0.40) ALDH1A1TSHRTDP1CA1CA2
Fluoride SCHEMBL915050 0.67 ALDH1A1 (0.40) ALDH1A1TSHRTDP1CA1CA2
Hydrochloric Acid SCHEMBL1847110 0.64 ALDH1A1 (0.38) ALDH1A1TSHRTDP1CA1CA2
Hydrochloric Acid SCHEMBL943271 0.64 ALDH1A1 (0.38) ALDH1A1TSHRTDP1CA1CA2
Biphenyl SCHEMBL27694501 0.64 ALDH1A1 (0.90) ALDH1A1TDP1CA1CA2LMNA
Biphenyl SCHEMBL2730917 0.64 ALDH1A1 (0.90) ALDH1A1TDP1CA1CA2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0023018-A1 Method of reducing the level of catalyst residues in polymers PHILLIPS PETROLEUM COMPANY (US) 1981-01-28 EP claimed
US-12216402-B2 Photoacid generator INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2025-02-04 US disclosed
US-20240069442-A1 PHOTOACID GENERATOR INTERNATIONAL BUSINESS MACHINES CORPORATION 2024-02-29 US disclosed
US-11846886-B2 Photoacid generator INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2023-12-19 US disclosed
US-20220163886-A1 PHOTOACID GENERATOR INTERNATIONAL BUSINESS MACHINES CORPORATION 2022-05-26 US disclosed
EP-0571945-A2 Catalyst for copolymerizing ethylene with alpha-olefin and process for producing ethylene-alpha-olefin copolymer using the catalyst SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1993-12-01 EP disclosed