SCHEMBL31584745

SCHEMBL31584745

CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCOC(=O)[C@@H](N)C(C)C.CCS(=O)(=O)O

nearest known ligand 0.49

Known targets — ChEMBL curated mechanism

FGFR1FGFR2FGFR3FGFR4FLT1FLT4KDRPDGFRAPDGFRB

The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 2/20 0.45
▸ NAAA Q02083 1/20 0.44
▸ TP53 P04637 1/20 0.43
▸ EPHX1 P07099 1/20 0.42
▸ CA1 P00915 8/20 0.41
▸ CA2 P00918 8/20 0.41
▸ CA9 Q16790 7/20 0.41
▸ CA12 O43570 3/20 0.41
▸ CA7 P43166 3/20 0.41
▸ CA14 Q9ULX7 3/20 0.41
▸ CA3 P07451 2/20 0.41
▸ CA4 P22748 2/20 0.41
▸ CA6 P23280 2/20 0.41
▸ CA5A P35218 2/20 0.41
▸ CA5B Q9Y2D0 2/20 0.41
▸ HTR2C P28335 1/20 0.41
▸ STS P08842 3/20 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
SCHEMBL31584710 0.92 NAAA (0.52) TSHRNAAAEPHX1HTR2C
SCHEMBL31584796 0.92 NAAA (0.52) TSHRNAAAEPHX1HTR2C
SCHEMBL7782139 0.92 NAAA (0.52) TSHRNAAAEPHX1HTR2C
SCHEMBL7782942 0.92 NAAA (0.52) TSHRNAAAEPHX1HTR2C
SCHEMBL7782136 0.92 NAAA (0.52) TSHRNAAAEPHX1HTR2C
SCHEMBL18672810 0.92 NAAA (0.52) TSHRNAAAEPHX1HTR2C
SCHEMBL7781605 0.92 NAAA (0.52) TSHRNAAAEPHX1HTR2C
SCHEMBL2214927 0.92 NAAA (0.52) TSHRNAAAEPHX1HTR2C
SCHEMBL2214933 0.92 NAAA (0.52) TSHRNAAAEPHX1HTR2C
SCHEMBL31584462 0.92 NAAA (0.52) TSHRNAAAEPHX1HTR2C

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-113677337-B Cationic compositions based on self-neutralizing amino acids 伊诺莱克斯投资公司 2025-05-23 — — CN disclosed
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