SCHEMBL7277166

SCHEMBL7277166

Cc1ccc(C)c(OC(C)C(=O)O)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.59
TSHR P16473 3/20 0.57
HTR2B P41595 2/20 0.57
HTR2A P28223 1/20 0.57
HTR2C P28335 1/20 0.57
KMT2A Q03164 2/20 0.50
CYP2C9 P11712 3/20 0.47
KDM4E B2RXH2 3/20 0.46
ALDH1A1 P00352 3/20 0.46
HPGD P15428 3/20 0.46
HSD17B10 Q99714 2/20 0.46
RAB9A P51151 1/20 0.45
CYP1A2 P05177 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
TTR P02766 1/20 0.44
CYP2C8 P10632 1/20 0.44
CHRM1 P11229 1/20 0.44
ADRA1A P35348 1/20 0.44
PPARG P37231 1/20 0.44
PPARA Q07869 1/20 0.44

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
SCHEMBL7392692 0.86 TSHR (0.71) TDP1TSHRHTR2BHTR2AHTR2C
SCHEMBL11689564 0.83 TDP1 (0.56) TDP1TSHRHTR2BHTR2AHTR2C
SCHEMBL8190106 0.83 TSHR (0.62) TDP1TSHRHTR2BHTR2AHTR2C
SCHEMBL572352 0.83 TSHR (0.77) TDP1TSHRHTR2BHTR2AHTR2C
SCHEMBL13973026 0.83 TSHR (0.58) TDP1TSHRHTR2BHTR2AHTR2C
SCHEMBL24419010 0.83 TSHR (0.48) TDP1TSHRKMT2ACYP2C9KDM4E
SCHEMBL1702623 0.83 TSHR (0.77) TDP1TSHRHTR2BHTR2AHTR2C
SCHEMBL233324 0.83 ALDH1A1 (0.52) TDP1TSHRHTR2BHTR2AHTR2C
SCHEMBL21991511 0.83 TSHR (0.47) TDP1TSHRHTR2BHTR2AHTR2C
SCHEMBL233034 0.83 TDP1 (0.56) TDP1TSHRHTR2BHTR2AHTR2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220409566-A1 CCL5 Inhibitors LAPKO INC, dba AFECTA PHARMACEUTICALS 2022-12-29 US disclosed
US-20220142961-A1 CCL5 Inhibitors LAPKO INC, dba AFECTA PHARMACEUTICALS 2022-05-12 US disclosed
US-11318111-B2 CCL5 inhibitors LAPKO INC (US) 2022-05-03 US disclosed
US-20210196665-A1 CCL5 Inhibitors AFECTA PHARMACEUTICALS, INC. (US) 2021-07-01 US disclosed
US-5010198-A Intermediates for the synthesis of benzoxazol- and benzothiazolamine derivatives, useful as anti-anoxic agents JANSSEN PHARMACEUTICA N.V. (BE) 1991-04-23 US disclosed
EP-0413839-A1 GHRH analogs The Administrators of The Tulane Educational Fund (US) 1991-02-27 EP disclosed
EP-0184257-B1 BENZOXAZOL- AND BENZOTHIAZOLAMINE DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 1990-07-25 EP disclosed
US-4914189-A STIMULATES RELEASE OF GROWTH HORMONE THE ADMINSTRATORS OF THE TULANE EDUCATIONAL FUND (US) 1990-04-03 US disclosed
US-4861785-A Benzoxazol-and benzothiazolamine derivatives, useful as anti-anoxic agents JANSSEN PHARMACEUTICA N.V. (BE) 1989-08-29 US disclosed
EP-0277626-A2 Synthetic GHRH analogs The Administrators of The Tulane Educational Fund (US) 1988-08-10 EP disclosed
EP-0184257-A1 Benzoxazol- and benzothiazolamine derivatives JANSSEN PHARMACEUTICA N.V. (BE) 1986-06-11 EP 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 (4 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-20220142961-A1 CCL5 Inhibitors CCL5, CCL11, CCR5 TDP1 1445/4885TSHR 3214/4885HTR2B 1578/4885
US-20210196665-A1 CCL5 Inhibitors CCL5, CCL11, CCR5 TDP1 1445/4885TSHR 3214/4885HTR2B 1578/4885
US-11318111-B2 CCL5 inhibitors CCL5, CCL11, CCR5 TDP1 1445/4885TSHR 3214/4885HTR2B 1578/4885
US-20220409566-A1 CCL5 Inhibitors CCL5, CCL11, CCR5 TDP1 1445/4885TSHR 3214/4885HTR2B 1578/4885

“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.