SCHEMBL27437192

SCHEMBL27437192

CC(=O)COC(=O)C1CCCC1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.46
SMN1; SMN2 Q16637 2/20 0.44
RXFP1 Q9HBX9 1/20 0.44
ADRB2 P07550 1/20 0.44
ADRB1 P08588 1/20 0.44
ADRB3 P13945 1/20 0.44
TSHR P16473 1/20 0.43
MDM2 Q00987 1/20 0.43
CASP3 P42574 1/20 0.43
SENP8 Q96LD8 1/20 0.43
SENP7 Q9BQF6 1/20 0.43
SENP6 Q9GZR1 1/20 0.43
ATM Q13315 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41

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
SCHEMBL27437194 0.98 ALDH1A1 (0.49) ALDH1A1SMN1; SMN2RXFP1ADRB2ADRB1
SCHEMBL27609193 0.91 MAPT (0.43) ALDH1A1SMN1; SMN2ATMTDP1
SCHEMBL6351424 0.83 ALDH1A1 (0.44) ALDH1A1SMN1; SMN2RXFP1ADRB2ADRB1
SCHEMBL25845608 0.82 GABRP (0.43) ALDH1A1SMN1; SMN2TSHRATMTDP1
SCHEMBL6359904 0.82 ALDH1A1 (0.46) ALDH1A1SMN1; SMN2RXFP1ADRB2ADRB1
SCHEMBL6201777 0.80 ATM (0.46) ALDH1A1SMN1; SMN2RXFP1ADRB2ADRB1
SCHEMBL2625619 0.78 ALDH1A1 (0.46) ALDH1A1SMN1; SMN2RXFP1TSHRMDM2
SCHEMBL18367 0.77 ALDH1A1 (0.68) ALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL20599675 0.76 ALDH1A1 (0.57) ALDH1A1TDP1MEN1KMT2A
SCHEMBL9806822 0.76 ALDH1A1 (0.71) ALDH1A1SMN1; SMN2TSHRMEN1KMT2A

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-12032290-B2 Actinic ray-sensitive or radiation-sensitive resin composition, resist film, pattern forming method, and method for manufacturing electronic device FUJIFILM CORPORATION (JP) 2024-07-09 US disclosed