SCHEMBL19065770

SCHEMBL19065770

O=C(N1CCN(Cc2cccc(OCc3ccccc3)c2)CC1)n1cccn1

nearest known ligand 0.81

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ FAAH O00519 4/20 0.61
▸ MGLL Q99685 2/20 0.58
▸ KDM4E B2RXH2 2/20 0.56
▸ LMNA P02545 2/20 0.56
▸ TSHR P16473 2/20 0.56
▸ ALDH1A1 P00352 1/20 0.56
▸ HPGD P15428 1/20 0.56
▸ ALOX12 P18054 1/20 0.56
▸ HTT P42858 1/20 0.56
▸ SMN1; SMN2 Q16637 1/20 0.56
▸ L3MBTL1 Q9Y468 1/20 0.52
▸ MEN1 O00255 1/20 0.52
▸ ALOX15 P16050 1/20 0.52
▸ KMT2A Q03164 1/20 0.52

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
SCHEMBL17276493 0.89 FAAH (0.60) FAAHKDM4EALDH1A1HTTSMN1; SMN2
SCHEMBL17281596 0.86 FAAH (0.54) FAAHMGLL
SCHEMBL17276252 0.84 ALDH1A1 (0.54) FAAHMGLLKDM4ELMNAALDH1A1
SCHEMBL17276307 0.83 FAAH (0.58) FAAHMGLLKDM4ELMNAALDH1A1
SCHEMBL3641921 0.82 FAAH (0.74) FAAHKDM4ELMNATSHRALDH1A1
SCHEMBL17276526 0.81 FAAH (0.67) FAAHMGLL
SCHEMBL17276626 0.80 FAAH (0.58) FAAHMGLLMEN1KMT2A
SCHEMBL19078732 0.80 ALDH1A1 (0.59) FAAHKDM4EALDH1A1HTTMEN1
SCHEMBL17276392 0.78 FAAH (0.52) FAAHMGLL
SCHEMBL17281583 0.78 FAAH (0.57) FAAHMGLLTSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10093630-B2 Pyrazole compounds and methods of making and using same ABIDE THERAPEUTICS, INC. (US) 2018-10-09 — — US disclosed
US-20170190669-A1 PYRAZOLE COMPOUNDS AND METHODS OF MAKING AND USING SAME H. LUNDBECK A/S (DK) 2017-07-06 — — US disclosed
US-20170190669-A1 PYRAZOLE COMPOUNDS AND METHODS OF MAKING AND USING SAME H. LUNDBECK A/S (DK) 2017-07-06 — — 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 (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-20170190669-A1 PYRAZOLE COMPOUNDS AND METHODS OF MAKING AND USING SAME ABHD6, FAAH, FAAH2 FAAH 2/4885MGLL 7/4885KDM4E 2168/4885
US-10093630-B2 Pyrazole compounds and methods of making and using same ABHD6, FAAH, FAAH2 FAAH 2/4885MGLL 7/4885KDM4E 2168/4885

“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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