SCHEMBL11512239

SCHEMBL11512239

O=C(O)c1ccc(C(=O)OOC(=O)c2ccc(C(=O)O)cc2)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.67
F2 P00734 1/20 0.67
LMNA P02545 1/20 0.67
TP53 P04637 1/20 0.67
SRD5A2 P31213 3/20 0.57
CA1 P00915 3/20 0.55
CA2 P00918 3/20 0.55
CA12 O43570 1/20 0.55
CA3 P07451 1/20 0.55
TYR P14679 1/20 0.55
DRD1 P21728 1/20 0.55
CA4 P22748 1/20 0.55
CA6 P23280 1/20 0.55
CA5A P35218 1/20 0.55
CA7 P43166 1/20 0.55
CA9 Q16790 1/20 0.55
CA14 Q9ULX7 1/20 0.55
CA5B Q9Y2D0 1/20 0.55
DAO P14920 1/20 0.52
NAPRT Q6XQN6 1/20 0.52

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
SCHEMBL21753711 0.90 TSHR (0.60) TSHRF2LMNATP53SRD5A2
Benzoyl Peroxide SCHEMBL2494185 0.90 LMNA (0.85) TSHRF2LMNATP53SRD5A2
SCHEMBL2393271 0.85 CA1 (0.56) TSHRF2LMNATP53SRD5A2
SCHEMBL21204867 0.85 F2 (0.61) TSHRF2LMNATP53SRD5A2
SCHEMBL28544043 0.84 CA1 (0.54) TSHRF2LMNATP53SRD5A2
SCHEMBL1269049 0.83 TSHR (0.67) TSHRTP53SRD5A2CA1CA2
SCHEMBL15129970 0.83 TSHR (0.67) TSHRTP53SRD5A2CA1CA2
SCHEMBL110030 0.83 TSHR (0.67) TSHRTP53SRD5A2CA1CA2
Terephthalic Acid SCHEMBL175823 0.82 TSHR (1.00) TSHRTP53SRD5A2CA1CA2
Terephthalic Acid SCHEMBL1655 0.82 TSHR (1.00) TSHRTP53SRD5A2CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116556046-B Method for simply and conveniently preparing high-temperature-resistant antioxidant polyphenylene sulfide fibers and product thereof 山东明化新材料有限公司 2024-06-28 CN claimed
CN-116556046-B Method for simply and conveniently preparing high-temperature-resistant antioxidant polyphenylene sulfide fibers and product thereof 山东明化新材料有限公司 2024-06-28 CN disclosed
CN-116556046-A Method for simply and conveniently preparing high-temperature-resistant antioxidant polyphenylene sulfide fibers and product thereof 山东明化新材料有限公司 2023-08-08 CN disclosed
US-4154695-A DIACYL PEROXIDE CONTAINING PHTHALOYL RADICAL INTEROX CHEMICALS LIMITED (GB) 1979-05-15 US disclosed