SCHEMBL21034799

SCHEMBL21034799

CC(C)(C)c1cc(C(C)(C)C)c(CCc2cc(O)c(C(C)(C)C)cc2C(C)(C)C)cc1O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 7/20 0.61
ALDH1A1 P00352 7/20 0.61
SMN1; SMN2 Q16637 4/20 0.61
CYP1A2 P05177 3/20 0.61
MAPT P10636 2/20 0.61
KDM4E B2RXH2 1/20 0.61
ATP2A2 P16615 1/20 0.61
ATP2A3 Q93084 1/20 0.61
TP53 P04637 4/20 0.45
LMNA P02545 4/20 0.45
CYP3A4 P08684 3/20 0.45
GAA P10253 2/20 0.45
HPGD P15428 1/20 0.45
CYP2C9 P11712 6/20 0.45
TYR P14679 2/20 0.45
HSD17B10 Q99714 2/20 0.45
NR1I2 O75469 1/20 0.45
MIF P14174 1/20 0.45
HTT P42858 1/20 0.45
NFE2L2 Q16236 1/20 0.45

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
SCHEMBL21002044 0.87 ALOX15 (0.47) ALOX15ALDH1A1SMN1; SMN2CYP1A2MAPT
SCHEMBL29822718 0.85 GAA (0.52) ALOX15ALDH1A1SMN1; SMN2CYP1A2MAPT
SCHEMBL29808669 0.84 ALOX15 (0.58) ALOX15ALDH1A1SMN1; SMN2CYP1A2MAPT
SCHEMBL2788258 0.84 ALOX15 (0.58) ALOX15ALDH1A1SMN1; SMN2CYP1A2MAPT
SCHEMBL30800911 0.83 ALOX5 (0.49) ALOX15ALDH1A1SMN1; SMN2CYP1A2MAPT
SCHEMBL10067473 0.83 ALOX5 (0.49) ALOX15ALDH1A1SMN1; SMN2CYP1A2MAPT
SCHEMBL29180392 0.83 ALOX5 (0.49) ALOX15ALDH1A1SMN1; SMN2CYP1A2MAPT
SCHEMBL29037594 0.80 GAA (0.49) ALOX15ALDH1A1SMN1; SMN2CYP1A2MAPT
SCHEMBL67854 0.80 ALOX15 (0.82) ALOX15ALDH1A1SMN1; SMN2CYP1A2MAPT
SCHEMBL9230440 0.78 ALOX15 (0.56) ALOX15ALDH1A1SMN1; SMN2CYP1A2MAPT

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-20200375949-A1 BISPHENOL COMPOUNDS TEMPLE UNIVERSITY - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION 2020-12-03 US disclosed
US-20200375949-A1 BISPHENOL COMPOUNDS TEMPLE UNIVERSITY - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION 2020-12-03 US disclosed
WO-2019104153-A1 BISPHENOL COMPOUNDS THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2019-05-31 WO 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-20200375949-A1 BISPHENOL COMPOUNDS RPP30, RPS10, RPS20 ALOX15 2231/4885ALDH1A1 1053/4885SMN1; SMN2 4506/4885

“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.