SCHEMBL10483701

SCHEMBL10483701

O=C(c1ccccc1)c1ccc(OC(=O)C2CC2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ELANE P08246 9/20 1.00
▸ POLB P06746 1/20 0.85
▸ KMT2A Q03164 3/20 0.59
▸ HTT P42858 1/20 0.59
▸ SMN1; SMN2 Q16637 1/20 0.59
▸ TDP1 Q9NUW8 1/20 0.59
▸ MEN1 O00255 2/20 0.54
▸ NPC1 O15118 1/20 0.54
▸ L3MBTL1 Q9Y468 1/20 0.51
▸ ALDH1A1 P00352 1/20 0.48
▸ STS P08842 1/20 0.47
▸ GAA P10253 1/20 0.47

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
SCHEMBL10483690 0.92 ELANE (1.00) ELANEPOLBKMT2AHTTSMN1; SMN2
SCHEMBL3079124 0.85 ELANE (0.73) ELANEPOLBKMT2AHTTSMN1; SMN2
SCHEMBL12642500 0.85 ELANE (0.73) ELANEPOLBKMT2AHTTSMN1; SMN2
SCHEMBL525974 0.85 ELANE (0.73) ELANEPOLBKMT2AHTTSMN1; SMN2
SCHEMBL3193624 0.85 ELANE (0.73) ELANEPOLBKMT2AHTTSMN1; SMN2
SCHEMBL12370828 0.85 ELANE (0.73) ELANEPOLBKMT2AHTTSMN1; SMN2
SCHEMBL28581457 0.85 ELANE (0.73) ELANEPOLBKMT2AHTTSMN1; SMN2
SCHEMBL28585415 0.85 ELANE (0.73) ELANEPOLBKMT2AHTTSMN1; SMN2
SCHEMBL28605208 0.85 ELANE (0.73) ELANEPOLBKMT2AHTTSMN1; SMN2
SCHEMBL28598290 0.85 ELANE (0.73) ELANEPOLBKMT2AHTTSMN1; SMN2

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
CN-113121331-A Phenoxy aromatic acid compound with cyclopropyl and pharmaceutically acceptable salt thereof, and preparation method and application thereof 华创合成制药股份有限公司 2021-07-16 — — CN claimed
US-4801610-A ANTIINFLAMMATORY G. D. SEARLE & CO. (US) 1989-01-31 — — US disclosed
US-4683241-A ANTIINFLAMMATORY AGENTS ENZYME INHIBITORS G. D. SEARLE & CO. (US) 1987-07-28 — — US disclosed
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