SCHEMBL6801907

SCHEMBL6801907

Cc1cccc(C(=O)O)c1-c1cccc(C(F)(F)F)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 1/20 0.51
RXRB P28702 1/20 0.51
ALDH1A1 P00352 2/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
XDH P47989 1/20 0.50
PIN1 Q13526 1/20 0.50
CNR2 P34972 1/20 0.50
TAS2R14 Q9NYV8 1/20 0.49
NOTUM Q6P988 1/20 0.49
SLC1A3 P43003 4/20 0.48
SLC1A2 P43004 4/20 0.48
SLC1A1 P43005 4/20 0.48
IKBKB O14920 1/20 0.48
BRD4 O60885 1/20 0.48
MYC P01106 1/20 0.47
KMO O15229 1/20 0.47
FABP4 P15090 1/20 0.47
KDM4E B2RXH2 1/20 0.46
HPGD P15428 1/20 0.46
HSD17B10 Q99714 1/20 0.46

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
SCHEMBL9621782 0.85 ALDH1A1 (0.54) ALDH1A1SMN1; SMN2XDHPIN1CNR2
SCHEMBL29979402 0.85 SMO (0.50) RXRARXRBALDH1A1TAS2R14MYC
SCHEMBL135115 0.85 SMO (0.50) RXRARXRBALDH1A1TAS2R14MYC
Hydrochloric Acid SCHEMBL6200222 0.84 SMO (0.49) RXRARXRBALDH1A1TAS2R14MYC
SCHEMBL11594946 0.82 BRD4 (0.46) RXRARXRBALDH1A1SMN1; SMN2XDH
SCHEMBL20272272 0.81 RXRB (0.60) RXRARXRBALDH1A1SMN1; SMN2XDH
SCHEMBL10224487 0.81 RXRB (0.78) RXRARXRBALDH1A1SMN1; SMN2XDH
SCHEMBL4363981 0.79 FABP4 (0.68) ALDH1A1MYCFABP4KDM4EHPGD
SCHEMBL4724483 0.78 PARP1 (0.59) ALDH1A1CNR2IKBKBKDM4EADORA1
Hydrochloric Acid SCHEMBL7605502 0.77 FABP4 (0.66) ALDH1A1MYCFABP4KDM4EHPGD

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-20040157866-A1 Amide compounds FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-08-12 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040157866-A1 Amide compounds APOB, NR1H2, NR1H3 RXRA 486/4885RXRB 217/4885ALDH1A1 2901/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.