SCHEMBL3032265

SCHEMBL3032265

CC[C@H](O)Cn1nc(Nc2cccc(Cl)c2F)nc1-c1cc(C)nc(C)c1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ RIPK1 Q13546 7/20 0.38
▸ IDO1 P14902 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.34
▸ HPGD P15428 1/20 0.34
▸ P2RX3 P56373 1/20 0.33
▸ CD38 P28907 2/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ CYP1A2 P05177 1/20 0.32
▸ CYP3A4 P08684 1/20 0.32
▸ CYP2C9 P11712 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32
▸ DRD2 P14416 1/20 0.32
▸ DRD3 P35462 1/20 0.32

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
SCHEMBL3032270 1.00 LMNA (0.39) LMNASMN1; SMN2RIPK1IDO1KDM4E
Hydrochloric Acid SCHEMBL3021424 0.99 LMNA (0.38) LMNASMN1; SMN2RIPK1IDO1KDM4E
SCHEMBL3027819 0.92 RIPK1 (0.38) LMNASMN1; SMN2RIPK1IDO1KDM4E
SCHEMBL3027829 0.92 RIPK1 (0.38) LMNASMN1; SMN2RIPK1IDO1KDM4E
Hydrochloric Acid SCHEMBL3032341 0.84 GRIN1 (0.33) LMNAKDM4EHPGDRAB9ACYP1A2
SCHEMBL3030992 0.82 GRIN1 (0.31) LMNAKDM4E
SCHEMBL3025931 0.79 GRIN1 (0.32) LMNAKDM4E
SCHEMBL3025929 0.79 GRIN1 (0.32) LMNAKDM4E
SCHEMBL3030717 0.77 KDM4E (0.36) SMN1; SMN2KDM4EHPGDRAB9A
SCHEMBL3030724 0.77 KDM4E (0.36) SMN1; SMN2KDM4EHPGDRAB9A

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-2212309-B1 TRISUBSTITUTED 1,2,4-TRIAZOLES JANSSEN PHARMACEUTICA NV (BE) 2013-06-19 — — EP disclosed
US-8440701-B2 Trisubstituted 1,2,4 triazoles JANSSEN PHARMACEUTICA NV (BE) 2013-05-14 — — US disclosed
US-20100216846-A1 TRISUBSTITUTED 1,2,4 TRIAZOLES JANSSEN PHARMACEUTICA NV (BE) 2010-08-26 — — US disclosed
EP-2212309-A1 TRISUBSTITUTED 1,2,4-TRIAZOLES Janssen Pharmaceutica N.V. (BE) 2010-08-04 — — EP disclosed
WO-2009050186-A1 TRISUBSTITUTED 1,2,4-TRIAZOLES JANSSEN PHARMACEUTICA NV (BE) 2009-04-23 — — WO 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-20100216846-A1 TRISUBSTITUTED 1,2,4 TRIAZOLES CHRNA1, CHRNA5, CHRNB1 LMNA 4483/4885SMN1; SMN2 3055/4885RIPK1 3273/4885

“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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