SCHEMBL24445666

SCHEMBL24445666

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

nearest known ligand 0.61

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.61
AOX1 Q06278 1/20 0.61
KDM4E B2RXH2 1/20 0.52
PTGS2 P35354 1/20 0.52
RAB9A P51151 1/20 0.52
TTR P02766 2/20 0.50
APP P05067 7/20 0.48
ALDH5A1 P51649 2/20 0.47
ABAT P80404 2/20 0.47
TRIM24 O15164 1/20 0.47
HPGD P15428 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
TRIM33 Q9UPN9 1/20 0.47
TSHR P16473 1/20 0.43
CYP1A2 P05177 1/20 0.39
MAPT P10636 1/20 0.39
EPHX2 P34913 1/20 0.38
FDPS P14324 1/20 0.38

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
SCHEMBL30203126 0.86 APP (0.63) ALDH1A1AOX1KDM4EPTGS2RAB9A
SCHEMBL856737 0.86 APP (0.63) ALDH1A1AOX1KDM4EPTGS2RAB9A
SCHEMBL1414751 0.83 ALDH1A1 (0.54) ALDH1A1AOX1KDM4EPTGS2RAB9A
SCHEMBL4130397 0.83 ALDH1A1 (0.63) ALDH1A1AOX1KDM4EPTGS2RAB9A
SCHEMBL20869201 0.82 ALDH1A1 (0.66) ALDH1A1AOX1KDM4EPTGS2RAB9A
SCHEMBL584601 0.80 EPHX2 (0.50) ALDH1A1AOX1APPALDH5A1ABAT
SCHEMBL7255672 0.79 ALDH1A1 (0.46) ALDH1A1AOX1RAB9ATDP1
SCHEMBL15664456 0.79 ALDH1A1 (0.43) ALDH1A1AOX1KDM4EPTGS2RAB9A
SCHEMBL7857195 0.79 ALDH1A1 (0.43) ALDH1A1AOX1KDM4EPTGS2RAB9A
SCHEMBL670456 0.79 ALDH1A1 (0.43) ALDH1A1AOX1KDM4EPTGS2RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11760701-B2 Difluoromethoxylation and trifluoromethoxylation compositions and methods for synthesizing same THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YROK (US) 2023-09-19 US disclosed
EP-4001336-A1 POLYURETHANE, POLYURETHANE PRODUCTION METHOD, CONDUCTIVE PASTE COMPOSITION, CONDUCTIVE WIRE, AND METHOD FOR PRODUCING CONDUCTIVE WIRE Shin-Etsu Chemical Co., Ltd. (JP) 2022-05-25 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 (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-11760701-B2 Difluoromethoxylation and trifluoromethoxylation compositions and methods for synthesizing same AFF2, AFF4, AFF1 ALDH1A1 1490/4885AOX1 529/4885KDM4E 840/4885

“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.