SCHEMBL29935616

SCHEMBL29935616

O=Cc1cc(F)ccc1-n1cncn1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.47
CYP2C9 P11712 2/20 0.47
CYP2C19 P33261 2/20 0.47
CYP3A4 P08684 1/20 0.47
ALDH1A1 P00352 4/20 0.46
KDM4E B2RXH2 3/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
HCRTR1 O43613 1/20 0.39
POLB P06746 1/20 0.38
TSHR P16473 1/20 0.37
MAPK1 P28482 1/20 0.37
HSD17B10 Q99714 1/20 0.37
MGLL Q99685 1/20 0.37
RAB9A P51151 1/20 0.36
RXFP1 Q9HBX9 1/20 0.36
MAPT P10636 1/20 0.36
HPGD P15428 1/20 0.36
BLM P54132 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
SCHEMBL30480716 0.81 CRHBP (0.47) ALDH1A1KDM4ESMN1; SMN2KMT2AMEN1
SCHEMBL1956908 0.81 ALDH1A1 (0.46) CYP1A2CYP2C9CYP2C19CYP3A4ALDH1A1
SCHEMBL616961 0.81 CRHBP (0.47) ALDH1A1KDM4ESMN1; SMN2KMT2AMEN1
SCHEMBL1957646 0.79 ALDH1A1 (0.51) CYP1A2CYP2C9CYP2C19CYP3A4ALDH1A1
SCHEMBL1485069 0.78 CYP3A4 (0.56) CYP1A2CYP2C9CYP2C19CYP3A4ALDH1A1
SCHEMBL1955237 0.78 KDM4E (0.43) CYP1A2CYP2C9CYP2C19CYP3A4ALDH1A1
SCHEMBL1956919 0.78 MAOB (0.47) CYP1A2CYP2C9CYP2C19CYP3A4ALDH1A1
SCHEMBL31133353 0.77 CYP1A2 (0.49) CYP1A2CYP2C9CYP2C19CYP3A4ALDH1A1
SCHEMBL21816086 0.77 CYP1A2 (0.49) CYP1A2CYP2C9CYP2C19CYP3A4ALDH1A1
SCHEMBL192940 0.77 ALDH1A1 (0.51) CYP1A2CYP2C9CYP2C19CYP3A4ALDH1A1

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
US-12577243-B2 Monoacylglycerol lipase modulators JANSSEN PHARMACEUTICA NV (BE) 2026-03-17 US disclosed
US-11820766-B2 Monoacylglycerol lipase modulators JANSSEN PHARMACEUTICA NV (BE) 2023-11-21 US disclosed
US-20230145249-A1 Monoacylglycerol Lipase Modulators JANSSEN PHARMACEUTICA NV (BE) 2023-05-11 US disclosed
US-20220332713-A1 Monoacylglycerol Lipase Modulators JANSSEN PHARMACEUTICA NV (BE) 2022-10-20 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 (4 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-20220332713-A1 Monoacylglycerol Lipase Modulators MGLL, LPL, PNLIP CYP1A2 540/4885CYP2C9 1000/4885CYP2C19 596/4885
US-12577243-B2 Monoacylglycerol lipase modulators MGLL, LPL, FAAH CYP1A2 611/4885CYP2C9 694/4885CYP2C19 589/4885
US-20230145249-A1 Monoacylglycerol Lipase Modulators MGLL, LPL, PNLIP CYP1A2 540/4885CYP2C9 1000/4885CYP2C19 596/4885
US-11820766-B2 Monoacylglycerol lipase modulators MGLL, LPL, PNLIP CYP1A2 540/4885CYP2C9 1000/4885CYP2C19 596/4885

“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.