SCHEMBL6499746

SCHEMBL6499746

CC(C)Oc1ccc(-c2ccc(F)cc2)c(C(=O)O)c1

nearest known ligand 0.59

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.59
SMN1; SMN2 Q16637 1/20 0.59
MCL1 Q07820 2/20 0.47
KMT2A Q03164 1/20 0.46
PTPN11 Q06124 2/20 0.46
HSD17B10 Q99714 1/20 0.45
FFAR4 Q5NUL3 6/20 0.45
RXRA P19793 1/20 0.44
RXRB P28702 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
DHODH Q02127 1/20 0.43
SLC6A4 P31645 1/20 0.43
SLC6A3 Q01959 1/20 0.43
KDM4E B2RXH2 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2D6 P10635 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43

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
SCHEMBL6492074 0.87 ALDH1A1 (0.61) ALDH1A1SMN1; SMN2MCL1KMT2APTPN11
SCHEMBL6489327 0.85 ALDH1A1 (0.59) ALDH1A1SMN1; SMN2MCL1KMT2APTPN11
SCHEMBL6490238 0.85 SMN1; SMN2 (0.82) SMN1; SMN2KMT2APTPN11HSD17B10SLC6A4
SCHEMBL6489788 0.85 ALDH1A1 (0.55) ALDH1A1SMN1; SMN2MCL1KMT2APTPN11
SCHEMBL6487707 0.81 SMN1; SMN2 (0.57) ALDH1A1SMN1; SMN2MCL1PTPN11HSD17B10
SCHEMBL31586500 0.79 HSD17B10 (0.58) ALDH1A1SMN1; SMN2KMT2AHSD17B10DHODH
SCHEMBL6498591 0.79 HSD17B10 (0.58) ALDH1A1SMN1; SMN2KMT2AHSD17B10DHODH
SCHEMBL6489261 0.79 HSD17B10 (0.47) ALDH1A1SMN1; SMN2KMT2AHSD17B10RXRA
SCHEMBL8984342 0.78 ALDH1A1 (0.67) ALDH1A1SMN1; SMN2MCL1KMT2AFFAR4
SCHEMBL8476474 0.78 ALDH1A1 (0.71) ALDH1A1MCL1KMT2AFFAR4RXRA

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-20050038035-A1 Heterocyclic amide compounds as apolipoprotein b inhibitors DAISO CO., LTD. (JP) 2005-02-17 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-20050038035-A1 Heterocyclic amide compounds as apolipoprotein b inhibitors APOB, APOL1, CTRB2 ALDH1A1 1603/4885SMN1; SMN2 1921/4885MCL1 2690/4885

“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.