SCHEMBL9851937

SCHEMBL9851937

CCCC(CO)CCC(CO)CCO

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.50
ALDH1A1 P00352 2/20 0.44
TSHR P16473 1/20 0.43
THRB P10828 1/20 0.35
CHRM1 P11229 1/20 0.31
AKR1A1 P14550 1/20 0.31
CHRM3 P20309 1/20 0.31
HTR2A P28223 1/20 0.31
HTR2C P28335 1/20 0.31
ADRA1A P35348 1/20 0.31
HRH1 P35367 1/20 0.31
DRD3 P35462 1/20 0.31
SLC6A3 Q01959 1/20 0.31
HDAC1 Q13547 1/20 0.31
HDAC2 Q92769 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL15187340 0.97
SCHEMBL15187318 0.97
SCHEMBL4661909 0.97
SCHEMBL25767160 0.88 TSHR (0.41) LMNAALDH1A1TSHRTHRBCHRM1
SCHEMBL282622 0.88
SCHEMBL6440319 0.85 TSHR (0.43) LMNAALDH1A1TSHRTHRBCHRM1
SCHEMBL1101221 0.85 TSHR (0.43) LMNAALDH1A1TSHRTHRBCHRM1
Hydrochloric Acid SCHEMBL29769105 0.85 LMNA (0.57) LMNAALDH1A1TSHRCHRM1AKR1A1
SCHEMBL28875282 0.85 THRB (0.44) LMNAALDH1A1THRB
SCHEMBL13195682 0.82

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0459592-A2 Modified epoxy resin composition SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1991-12-04 EP disclosed
EP-0281213-A2 Process for the preparation of a modified epoxy resin SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1988-09-07 EP disclosed