SCHEMBL18191630

SCHEMBL18191630

Cn1nc(C(=O)N(CC(=O)NC[C@@H]2CCCO2)Cc2ccccc2F)c2c1-c1cc(Cl)ccc1OC2

nearest known ligand 0.57

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ NR1H4 Q96RI1 14/20 0.57
▸ USP2 O75604 1/20 0.47
▸ CYP3A4 P08684 1/20 0.45
▸ CYP2D6 P10635 1/20 0.45
▸ CYP2C19 P33261 1/20 0.45
▸ ALDH1A1 P00352 1/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ TSHR P16473 1/20 0.43

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
SCHEMBL18191643 1.00 NR1H4 (0.57) NR1H4USP2CYP3A4CYP2D6CYP2C19
SCHEMBL18191622 0.91 NR1H4 (0.60) NR1H4
SCHEMBL18191595 0.90 NR1H4 (0.55) NR1H4USP2CYP3A4CYP2D6CYP2C19
SCHEMBL18191649 0.90 NR1H4 (0.57) NR1H4CYP3A4CYP2D6CYP2C19ALDH1A1
SCHEMBL18191611 0.89 NR1H4 (0.56) NR1H4USP2CYP3A4CYP2D6CYP2C19
SCHEMBL18191661 0.88 NR1H4 (0.63) NR1H4
SCHEMBL18191667 0.88 NR1H4 (0.59) NR1H4ALDH1A1
SCHEMBL18191585 0.88 NR1H4 (0.59) NR1H4ALDH1A1
SCHEMBL18191574 0.88 NR1H4 (0.60) NR1H4ALDH1A1
SCHEMBL18191659 0.87 NR1H4 (0.63) NR1H4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3288948-B1 FUSED TRICYCLIC PYRAZOLE DERIVATIVES USEFUL FOR MODULATING FARNESOID X RECEPTORS NOVARTIS AG (CH) 2019-11-20 — — EP claimed
US-10351576-B2 Fused tricyclic pyrazole derivatives useful for farnesoid X receptors NOVARTIS AG (CH) 2019-07-16 — — US claimed
US-20180298018-A1 FUSED TRICYCLIC PYRAZOLE DERIVATIVES USEFUL FOR FARNESOID X RECEPTORS NOVARTIS AG (CH) 2018-10-18 — — US claimed
EP-3288948-A1 FUSED TRICYCLIC PYRAZOLE DERIVATIVES USEFUL FOR MODULATING FARNESOID X RECEPTORS Novartis AG (CH) 2018-03-07 — — EP claimed
WO-2016174616-A1 FUSED TRICYCLIC PYRAZOLE DERIVATIVES USEFUL FOR MODULATING FARNESOID X RECEPTORS NOVARTIS AG (CH) 2016-11-03 — — WO claimed
EP-3288948-B1 FUSED TRICYCLIC PYRAZOLE DERIVATIVES USEFUL FOR MODULATING FARNESOID X RECEPTORS NOVARTIS AG (CH) 2019-11-20 — — EP disclosed
EP-3288948-B1 FUSED TRICYCLIC PYRAZOLE DERIVATIVES USEFUL FOR MODULATING FARNESOID X RECEPTORS NOVARTIS AG (CH) 2019-11-20 — — EP disclosed
US-10351576-B2 Fused tricyclic pyrazole derivatives useful for farnesoid X receptors NOVARTIS AG (CH) 2019-07-16 — — US disclosed
US-10351576-B2 Fused tricyclic pyrazole derivatives useful for farnesoid X receptors NOVARTIS AG (CH) 2019-07-16 — — US disclosed
US-20180298018-A1 FUSED TRICYCLIC PYRAZOLE DERIVATIVES USEFUL FOR FARNESOID X RECEPTORS NOVARTIS AG (CH) 2018-10-18 — — US disclosed
EP-3288948-A1 FUSED TRICYCLIC PYRAZOLE DERIVATIVES USEFUL FOR MODULATING FARNESOID X RECEPTORS Novartis AG (CH) 2018-03-07 — — EP disclosed
WO-2016174616-A1 FUSED TRICYCLIC PYRAZOLE DERIVATIVES USEFUL FOR MODULATING FARNESOID X RECEPTORS NOVARTIS AG (CH) 2016-11-03 — — WO disclosed
WO-2016174616-A1 FUSED TRICYCLIC PYRAZOLE DERIVATIVES USEFUL FOR MODULATING FARNESOID X RECEPTORS NOVARTIS AG (CH) 2016-11-03 — — 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 (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-20180298018-A1 FUSED TRICYCLIC PYRAZOLE DERIVATIVES USEFUL FOR FARNESOID X RECEPTORS NR1H4, FXR1, GPBAR1 NR1H4 1/4885USP2 4300/4885CYP3A4 89/4885
US-10351576-B2 Fused tricyclic pyrazole derivatives useful for farnesoid X receptors NR1H4, FXR1, GPBAR1 NR1H4 1/4885USP2 4300/4885CYP3A4 89/4885

“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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