SCHEMBL20654847

SCHEMBL20654847

CCCCOCCC(F)(F)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 4/20 0.42
▸ ALDH1A1 P00352 2/20 0.42
▸ HPGD P15428 1/20 0.41
▸ LTA4H P09960 2/20 0.41
▸ RECQL P46063 1/20 0.38
▸ HRH3 Q9Y5N1 2/20 0.37
▸ CYP1A2 P05177 1/20 0.36
▸ CYP2C9 P11712 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ PTGDR2 Q9Y5Y4 1/20 0.36
▸ MEN1 O00255 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ RARB P10826 1/20 0.35

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
SCHEMBL10232106 0.84 LTA4H (0.42) TSHRALDH1A1HPGDLTA4HRECQL
SCHEMBL12409056 0.81 ALDH1A1 (0.42) TSHRALDH1A1LTA4H
SCHEMBL2009823 0.80 HDAC1 (0.36) TSHRALDH1A1MEN1KMT2A
SCHEMBL16933755 0.80 ALDH1A1 (0.41) TSHRALDH1A1LTA4HMEN1KMT2A
Trifluoromethylbenzene SCHEMBL9651235 0.79 ALDH1A1 (0.52) TSHRALDH1A1HPGDLTA4HPTGDR2
SCHEMBL2323605 0.78 SIGMAR1 (0.40) TSHRALDH1A1MEN1KMT2A
SCHEMBL16933716 0.78 SIGMAR1 (0.40) TSHRALDH1A1MEN1KMT2A
SCHEMBL20636787 0.78 SIGMAR1 (0.40) TSHRALDH1A1MEN1KMT2A
SCHEMBL16367918 0.78 CES1 (0.49) TSHRALDH1A1LTA4HHRH3
SCHEMBL1722311 0.78 CES1 (0.49) TSHRALDH1A1LTA4HHRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3925945-A1 METHOD FOR PRODUCING FLUORINATED COMPOUND Daikin Industries, Ltd. (JP) 2021-12-22 — — EP disclosed
EP-3428145-B1 METHOD FOR PRODUCING FLUORINATED COMPOUND DAIKIN IND LTD (JP) 2021-09-08 — — EP disclosed
US-20190071376-A1 METHOD FOR PRODUCING FLUORINATED COMPOUND DAIKIN INDUSTRIES, LTD. (JP) 2019-03-07 — — US disclosed
EP-3428145-A1 METHOD FOR PRODUCING FLUORINATED COMPOUND Daikin Industries, Ltd. (JP) 2019-01-16 — — 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-20190071376-A1 METHOD FOR PRODUCING FLUORINATED COMPOUND RXFP2, BLVRB, AFF2 TSHR 172/4885ALDH1A1 1416/4885HPGD 990/4885

“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.

Send feedback