SCHEMBL21484060

SCHEMBL21484060

[CH2]/C=C/C/C=C/C/C=C/C

nearest known ligand 0.31

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.31
F13A1 P00488 1/20 0.31
MAPT P10636 1/20 0.31
THRB P10828 1/20 0.31
PTGS1 P23219 1/20 0.31
FASN P49327 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL28939351 1.00 ALDH1A1 (0.31) ALDH1A1F13A1MAPTTHRBPTGS1
SCHEMBL21484062 1.00 ALDH1A1 (0.31) ALDH1A1F13A1MAPTTHRBPTGS1
SCHEMBL28730954 1.00 ALDH1A1 (0.31) ALDH1A1F13A1MAPTTHRBPTGS1
SCHEMBL1112233 0.97
SCHEMBL1112236 0.97
SCHEMBL19973702 0.86 ALDH1A1 (0.35) ALDH1A1F13A1MAPTTHRBPTGS1
SCHEMBL19973700 0.86 ALDH1A1 (0.35) ALDH1A1F13A1MAPTTHRBPTGS1
SCHEMBL8568123 0.83 TSHR (0.37) ALDH1A1F13A1MAPTTHRBPTGS1
SCHEMBL8568120 0.83 TSHR (0.37) ALDH1A1F13A1MAPTTHRBPTGS1
SCHEMBL8568126 0.83 TSHR (0.37) ALDH1A1F13A1MAPTTHRBPTGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3556464-B1 METHOD FOR PRODUCING REDUCED HALIDE COMPOUND HAVING UNDERGONE REDUCTION OF CARBON-CARBON UNSATURATED BOND SHINETSU CHEMICAL CO (JP) 2023-08-02 EP disclosed
CN-110386863-B Method for producing reduced halide having reduced carbon-carbon unsaturated bond 信越化学工业株式会社 2023-02-28 CN disclosed
US-10676417-B2 Method for producing reduced halide compound having undergone reduction of carbon-carbon unsaturated bond SHIN-ETSU CHEMICAL CO., LTD. (JP) 2020-06-09 US disclosed
US-20190322607-A1 METHOD FOR PRODUCING REDUCED HALIDE COMPOUND HAVING UNDERGONE REDUCTION OF CARBON-CARBON UNSATURATED BOND SHIN-ETSU CHEMICAL CO., LTD. (JP) 2019-10-24 US disclosed
EP-3556464-A1 METHOD FOR PRODUCING REDUCED HALIDE COMPOUND HAVING UNDERGONE REDUCTION OF CARBON-CARBON UNSATURATED BOND Shin-Etsu Chemical Co., Ltd. (JP) 2019-10-23 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 (2 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-20190322607-A1 METHOD FOR PRODUCING REDUCED HALIDE COMPOUND HAVING UNDERGONE REDUCTION OF CARBON-CARBON UNSATURATED BOND CBR1, CBR3, DECR1 ALDH1A1 907/4885F13A1 1834/4885MAPT 3971/4885
US-10676417-B2 Method for producing reduced halide compound having undergone reduction of carbon-carbon unsaturated bond CBR1, CBR3, DECR1 ALDH1A1 907/4885F13A1 1834/4885MAPT 3971/4885

“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.