SCHEMBL24251364

SCHEMBL24251364

Cc1nn2c(C(C)(C)C)c(C(=O)N[C@H]3CCOc4ccccc43)ccc2c1-c1c(F)cccc1Cl

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ HSD17B2 P37059 1/20 0.38
▸ P2RX7 Q99572 2/20 0.38
▸ BRD4 O60885 2/20 0.38
▸ CREBBP Q92793 2/20 0.38
▸ TAS1R3 Q7RTX0 4/20 0.35
▸ TAS1R1 Q7RTX1 4/20 0.35
▸ TAS1R2 Q8TE23 4/20 0.35
▸ LMNA P02545 1/20 0.35
▸ NTRK1 P04629 1/20 0.35
▸ BDKRB1 P46663 4/20 0.35
▸ TRPV1 Q8NER1 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ HPGD P15428 1/20 0.34
▸ CNR1 P21554 1/20 0.33
▸ CNR2 P34972 1/20 0.33

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
SCHEMBL24251517 0.94 HSD17B2 (0.41) HSD17B2BRD4CREBBPTAS1R3TAS1R1
SCHEMBL24251515 0.89 HSD17B2 (0.40) HSD17B2BRD4CREBBPTAS1R3TAS1R1
SCHEMBL24251434 0.88 HSD17B2 (0.44) HSD17B2P2RX7BRD4CREBBPTAS1R3
SCHEMBL24251567 0.88 P2RX7 (0.38) HSD17B2P2RX7BRD4CREBBPTAS1R3
SCHEMBL24251365 0.88 P2RX7 (0.40) HSD17B2P2RX7BRD4CREBBPTAS1R3
SCHEMBL23355445 0.86 P2RX7 (0.40) HSD17B2P2RX7BRD4CREBBPTAS1R3
SCHEMBL30933444 0.86 P2RX7 (0.40) HSD17B2P2RX7BRD4CREBBPTAS1R3
SCHEMBL24251354 0.82 BRD4 (0.40) HSD17B2BRD4CREBBPTAS1R3TAS1R1
SCHEMBL23355416 0.82 BRD4 (0.40) HSD17B2BRD4CREBBPTAS1R3TAS1R1
SCHEMBL24251356 0.81 BRD4 (0.41) HSD17B2BRD4CREBBPTAS1R3TAS1R1

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 HSD17B2 909/4885P2RX7 781/4885BRD4 2177/4885

“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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