SCHEMBL17366254

SCHEMBL17366254

CCCC(C)Oc1ccccc1F

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 1/20 0.48
ALDH1A1 P00352 2/20 0.45
GAA P10253 1/20 0.45
L3MBTL1 Q9Y468 2/20 0.43
LMNA P02545 3/20 0.42
PPARG P37231 1/20 0.41
PPARA Q07869 1/20 0.41
HPGD P15428 1/20 0.41
NPSR1 Q6W5P4 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
DHODH Q02127 7/20 0.38
TP53 P04637 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
PKM P14618 1/20 0.37
TAS1R3 Q7RTX0 1/20 0.36
TAS1R1 Q7RTX1 1/20 0.36

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
SCHEMBL9060740 0.88 L3MBTL1 (0.44) MCHR1ALDH1A1GAAL3MBTL1LMNA
SCHEMBL9060171 0.88 L3MBTL1 (0.44) MCHR1ALDH1A1GAAL3MBTL1LMNA
SCHEMBL11838849 0.86 MCHR1 (0.54) MCHR1ALDH1A1PPARGPPARASMN1; SMN2
SCHEMBL17366266 0.85 ALDH1A1 (0.47) MCHR1ALDH1A1GAAL3MBTL1LMNA
SCHEMBL5752456 0.82 ALDH1A1 (0.43) MCHR1ALDH1A1GAAL3MBTL1LMNA
SCHEMBL2208587 0.80 L3MBTL1 (0.42) ALDH1A1GAAL3MBTL1LMNAPPARG
SCHEMBL20269984 0.79 ALDH1A1 (0.46) MCHR1ALDH1A1GAAL3MBTL1LMNA
SCHEMBL8596342 0.79 ALDH1A1 (0.50) ALDH1A1GAAL3MBTL1LMNAPPARG
SCHEMBL22513126 0.78 MCHR1 (0.48) MCHR1L3MBTL1HPGDNPSR1DHODH
SCHEMBL17366287 0.78 MCHR1 (0.48) MCHR1ALDH1A1L3MBTL1HPGDTDP1

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-20220048915-A1 Nitrogen-containing Heterocyclic Compound and Composition Thereof, Preparation Method Therefor, and Application Thereof SHANGHAI PHARMACEUTICALS HOLDING CO., LTD. (CN) 2022-02-17 US disclosed
EP-2588451-B1 PIPERIDINE DERIVATIVES AND THEIR USE FOR THE TREATMENT OF METABOLIC DISORDERS BOEHRINGER INGELHEIM INT (DE) 2015-12-30 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-20220048915-A1 Nitrogen-containing Heterocyclic Compound and Composition Thereof, Preparation Method Therefor, and Application Thereof MAPK11, WEE1, NOS1 MCHR1 3973/4885ALDH1A1 3002/4885GAA 4372/4885

“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.