SCHEMBL16657248

SCHEMBL16657248

CCOC(=O)C(O)c1c(C)c(C)c2ccccc2c1OS(=O)(=O)C(F)(F)F

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.39
MAPT P10636 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HSD17B10 Q99714 1/20 0.39
ATM Q13315 2/20 0.36
ADORA3 P0DMS8 1/20 0.36
KMT2A Q03164 3/20 0.35
MEN1 O00255 2/20 0.35
TSHR P16473 2/20 0.35
LMNA P02545 1/20 0.35
POLB P06746 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
PIN1 Q13526 2/20 0.35
NPC1 O15118 1/20 0.34
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 2/20 0.34
MAPK1 P28482 1/20 0.33
HPGD P15428 1/20 0.33

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
SCHEMBL15099628 1.00 HTT (0.39) HTTMAPTSMN1; SMN2HSD17B10ATM
SCHEMBL1699720 0.91 HTT (0.38) HTTMAPTSMN1; SMN2HSD17B10ATM
SCHEMBL15165305 0.91 HTT (0.38) HTTMAPTSMN1; SMN2HSD17B10ATM
SCHEMBL15165314 0.90 MAPT (0.38) HTTMAPTSMN1; SMN2HSD17B10ATM
SCHEMBL1699539 0.90 MAPT (0.38) HTTMAPTSMN1; SMN2HSD17B10ATM
SCHEMBL10271719 0.90 HTT (0.38) HTTMAPTSMN1; SMN2HSD17B10ATM
SCHEMBL15093426 0.88 CXCR2 (0.34) HTTMAPTSMN1; SMN2HSD17B10LMNA
SCHEMBL15099627 0.84 HTT (0.37) HTTMAPTSMN1; SMN2HSD17B10ATM
SCHEMBL1699632 0.83 HSD17B10 (0.38) HTTMAPTSMN1; SMN2HSD17B10ATM
SCHEMBL10271718 0.83 HSD17B10 (0.38) HTTMAPTSMN1; SMN2HSD17B10ATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9284323-B2 Naphthalene acetic acid derivatives against HIV infection GILEAD SCIENCES, INC. (US) 2016-03-15 US disclosed
US-20150111891-A1 NAPHTHALENE ACETIC ACID DERIVATIVES AGAINST HIV INFECTION GILEAD SCIENCES, INC. (US) 2015-04-23 US disclosed
US-20150111891-A1 NAPHTHALENE ACETIC ACID DERIVATIVES AGAINST HIV INFECTION GILEAD SCIENCES, INC. (US) 2015-04-23 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-20150111891-A1 NAPHTHALENE ACETIC ACID DERIVATIVES AGAINST HIV INFECTION NFATC1, ACIN1, NAAA HTT 1606/4885MAPT 671/4885SMN1; SMN2 2614/4885

“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.