SCHEMBL24251582

SCHEMBL24251582

CCC(NC(=O)c1ccc2c(-c3c(F)cccc3F)c(C)nn2c1C(C)C)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 7/20 0.46
▸ KDM4E B2RXH2 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.43
▸ LMNA P02545 1/20 0.43
▸ HPGD P15428 1/20 0.43
▸ TSHR P16473 1/20 0.43
▸ HSD17B10 Q99714 1/20 0.43
▸ PDE2A O00408 1/20 0.41
▸ MAPK1 P28482 3/20 0.41
▸ TACR3 P29371 5/20 0.40
▸ KCNA5 P22460 1/20 0.39
▸ TACR2 P21452 2/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ CYP2D6 P10635 1/20 0.39
▸ CYP2C9 P11712 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ ROCK1 Q13464 2/20 0.39

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
SCHEMBL24251412 0.89 MEN1 (0.46) KDM4EALDH1A1LMNAHPGDHSD17B10
SCHEMBL24251585 0.84 RIPK1 (0.42) PPARGALDH1A1MAPK1TACR3KCNA5
SCHEMBL24251422 0.83 ALDH1A1 (0.46) KDM4EALDH1A1LMNAHPGDHSD17B10
SCHEMBL23355438 0.81 PDE4B (0.35) KDM4EALDH1A1HPGDHSD17B10
SCHEMBL24251388 0.81 PDE2A (0.43) ALDH1A1LMNAPDE2AROCK1
SCHEMBL24251556 0.81 PDE2A (0.43) ALDH1A1LMNAPDE2AROCK1
SCHEMBL24251405 0.80 ROCK2 (0.35) PPARGALDH1A1LMNAROCK1
SCHEMBL24251378 0.79 IMPDH2 (0.37) PPARGALDH1A1LMNATACR3
SCHEMBL24251371 0.79 KMT2A (0.41) PPARGALDH1A1HPGDROCK1
SCHEMBL23355480 0.78 KMT2A (0.37) KDM4EALDH1A1HPGDHSD17B10MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220048903-A1 Anthelminthic Heterocyclic Compounds BOEHRINGER INGELHEIM VETMEDICA GMBH (DE) 2022-02-17 — — 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-20220048903-A1 Anthelminthic Heterocyclic Compounds SDHA, PAH, PIGS PPARG 686/4885KDM4E 1862/4885ALDH1A1 212/4885

“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.

Send feedback