SCHEMBL23963260

SCHEMBL23963260

C=CC(=O)OCC1CC2CC1C(F)(F)C2(O)F

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 5/20 0.35
▸ ALDH1A1 P00352 3/20 0.32
▸ TP53 P04637 2/20 0.32
▸ HIF1A Q16665 2/20 0.32
▸ CYP3A4 P08684 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32

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
SCHEMBL18400944 0.84 TSHR (0.32) TSHR
SCHEMBL21281785 0.81 TSHR (0.32) TSHR
SCHEMBL18758018 0.81 TSHR (0.32) TSHR
SCHEMBL22432364 0.77 — —
SCHEMBL23963208 0.74 TSHR (0.35) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL20820983 0.72 — —
SCHEMBL18492313 0.70 RET (0.44) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL17213207 0.70 RET (0.44) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL19807192 0.69 TSHR (0.33) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL18401066 0.69 TSHR (0.33) TSHRALDH1A1TP53HIF1ACYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210333712-A1 IODIZED AROMATIC CARBOXYLIC ACID TYPE PENDANT-CONTAINING POLYMER, RESIST COMPOSITION AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2021-10-28 — — US disclosed
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