SCHEMBL29587642

SCHEMBL29587642

Cc1cc(O)c(C(C)(C)C)cc1Cl

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.58
ALOX15 P16050 5/20 0.58
SMN1; SMN2 Q16637 5/20 0.58
CYP1A2 P05177 2/20 0.58
KDM4E B2RXH2 2/20 0.58
MAPT P10636 1/20 0.58
ATP2A2 P16615 1/20 0.58
ATP2A3 Q93084 1/20 0.58
TP53 P04637 4/20 0.57
HIF1A Q16665 2/20 0.57
CYP3A4 P08684 2/20 0.57
TSHR P16473 2/20 0.57
TDP1 Q9NUW8 2/20 0.57
MAPK1 P28482 1/20 0.57
LMNA P02545 3/20 0.48
CYP2C9 P11712 4/20 0.47
CYP2C19 P33261 3/20 0.47
CYP2D6 P10635 1/20 0.47
HPGD P15428 1/20 0.44
TYR P14679 2/20 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
SCHEMBL225785 1.00 ALDH1A1 (0.58) ALDH1A1ALOX15SMN1; SMN2CYP1A2KDM4E
SCHEMBL16117675 0.91 ALDH1A1 (0.58) ALDH1A1ALOX15SMN1; SMN2CYP1A2KDM4E
SCHEMBL16117670 0.84 ALDH1A1 (0.67) ALDH1A1ALOX15SMN1; SMN2CYP1A2KDM4E
SCHEMBL16736702 0.82 ALOX15 (0.71) ALDH1A1ALOX15SMN1; SMN2CYP1A2KDM4E
SCHEMBL395984 0.81 ALOX15 (0.70) ALDH1A1ALOX15SMN1; SMN2CYP1A2KDM4E
SCHEMBL29872633 0.81 ALOX15 (0.70) ALDH1A1ALOX15SMN1; SMN2CYP1A2KDM4E
SCHEMBL5470246 0.79 ALOX15 (0.75) ALDH1A1ALOX15SMN1; SMN2CYP1A2KDM4E
SCHEMBL9074167 0.79 SMN1; SMN2 (0.42) ALDH1A1ALOX15SMN1; SMN2CYP1A2KDM4E
SCHEMBL19198900 0.79 SMN1; SMN2 (0.42) ALDH1A1ALOX15SMN1; SMN2CYP1A2KDM4E
SCHEMBL824520 0.79 ALOX15 (0.67) ALDH1A1ALOX15SMN1; SMN2CYP1A2KDM4E

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-11352330-B2 Phenoxymethyl derivatives HOFFMANN-LA ROCHE INC. (US) 2022-06-07 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-11352330-B2 Phenoxymethyl derivatives CNKSR1, RB1, RCOR1 ALDH1A1 131/4885ALOX15 3210/4885SMN1; SMN2 4115/4885

“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.