SCHEMBL14358003

SCHEMBL14358003

CC(C)(C)OC(=O)N1CCCC(=O)/C1=C/c1ccc(F)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 4/20 0.38
▸ KMT2A Q03164 4/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ HSD11B1 P28845 2/20 0.38
▸ GRM5 P41594 1/20 0.36
▸ GRM1 Q13255 1/20 0.36
▸ RORC P51449 3/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ S1PR2 O95136 1/20 0.35
▸ NPC1 O15118 1/20 0.35
▸ EGFR P00533 1/20 0.35
▸ BRD4 O60885 1/20 0.35
▸ MAPT P10636 2/20 0.34
▸ POLB P06746 1/20 0.34
▸ THRB P10828 1/20 0.34
▸ HTT P42858 1/20 0.34
▸ RECQL P46063 1/20 0.34
▸ BLM P54132 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34

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
SCHEMBL5447566 1.00 MEN1 (0.38) MEN1KMT2AALDH1A1RAB9AHSD11B1
SCHEMBL29997473 0.84 ALDH1A1 (0.39) MEN1KMT2AALDH1A1RAB9ASMN1; SMN2
SCHEMBL12266171 0.80 ACHE (0.44) MEN1KMT2AALDH1A1HSD11B1GRM5
SCHEMBL2397980 0.80 ACHE (0.44) MEN1KMT2AALDH1A1HSD11B1GRM5
SCHEMBL20015582 0.76 GRM5 (0.43) MEN1KMT2AALDH1A1GRM5GRM1
SCHEMBL21369533 0.76 ESR2 (0.43) MEN1KMT2AALDH1A1GRM5GRM1
SCHEMBL5341385 0.76 ESR2 (0.43) MEN1KMT2AALDH1A1GRM5GRM1
SCHEMBL20015306 0.76 GRM5 (0.43) MEN1KMT2AALDH1A1GRM5GRM1
SCHEMBL5341383 0.76 ESR2 (0.43) MEN1KMT2AALDH1A1GRM5GRM1
SCHEMBL1030522 0.75 ACHE (0.46) MEN1KMT2AHSD11B1GRM5GRM1

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-20070254911-A1 Tetrahydro-Pyrazolo[3,4-c]Pyridine Cannabinoid Modulators JANSSEN PHARMACEUTICA N.V. (BE) 2007-11-01 — — US disclosed
US-20070254911-A1 Tetrahydro-Pyrazolo[3,4-c]Pyridine Cannabinoid Modulators JANSSEN PHARMACEUTICA N.V. (BE) 2007-11-01 — — 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-20070254911-A1 Tetrahydro-Pyrazolo[3,4-c]Pyridine Cannabinoid Modulators CNR1, CNR2, GPR18 MEN1 3547/4885KMT2A 3133/4885ALDH1A1 3126/4885

“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.

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