SCHEMBL29264357

SCHEMBL29264357

Cc1cc(C(=O)O)cc(F)c1I

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TPMT P51580 4/20 0.48
▸ LMNA P02545 2/20 0.42
▸ MAPK1 P28482 2/20 0.42
▸ HTT P42858 1/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ HSD17B10 Q99714 2/20 0.40
▸ CA12 O43570 2/20 0.40
▸ CA1 P00915 2/20 0.40
▸ CA2 P00918 2/20 0.40
▸ CA7 P43166 2/20 0.40
▸ CA9 Q16790 2/20 0.40
▸ CA14 Q9ULX7 2/20 0.40
▸ TDP1 Q9NUW8 2/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ TP53 P04637 1/20 0.40
▸ CA3 P07451 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ SELL P14151 1/20 0.40
▸ HPGD P15428 1/20 0.40

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
SCHEMBL16384671 0.85 TPMT (0.58) TPMTLMNAMAPK1HSD17B10CA12
SCHEMBL12013947 0.79 LMNA (0.48) TPMTLMNAMAPK1HTTRAB9A
SCHEMBL2183846 0.79 CES2 (0.48) TPMTLMNAMAPK1HTTRAB9A
SCHEMBL23817375 0.79 TPMT (0.71) TPMTLMNAMAPK1HSD17B10CA12
SCHEMBL27910659 0.78 TPMT (0.50) TPMTLMNARAB9AHSD17B10CA12
SCHEMBL6092664 0.78 CA12 (0.52) TPMTLMNAMAPK1HTTRAB9A
SCHEMBL1105952 0.76 HDAC1 (0.59) TPMTLMNAMAPK1HTTRAB9A
SCHEMBL7827636 0.76 TPMT (0.54) TPMTLMNAMAPK1HTTRAB9A
SCHEMBL20094254 0.76 TPMT (0.54) TPMTLMNAMAPK1HSD17B10CA12
SCHEMBL1233792 0.76 TPMT (0.54) TPMTLMNAMAPK1HTTRAB9A

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
CN-118271340-A Heterospiro compounds, mixtures and electroluminescent devices 武汉华星光电半导体显示技术有限公司 2024-07-02 — — CN disclosed
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