SCHEMBL24667338

SCHEMBL24667338

CC(C)(C)N1CCC(NC(=O)c2ccc(C(F)(F)F)cc2Cl)c2ccc(F)cc21

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 1/20 0.46
▸ CRHR1 P34998 6/20 0.43
▸ CRHR2 Q13324 1/20 0.43
▸ PDK2 Q15119 1/20 0.43
▸ NTRK1 P04629 1/20 0.40
▸ HTR1F P30939 1/20 0.38
▸ SPTLC2 O15270 1/20 0.38
▸ NPY2R P49146 1/20 0.38
▸ MAP3K12 Q12852 1/20 0.38
▸ TRPV1 Q8NER1 1/20 0.38
▸ SLC6A9 P48067 1/20 0.37

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
SCHEMBL24665420 0.88 TEAD1 (0.46) CRHR1CRHR2PDK2NTRK1SPTLC2
SCHEMBL24665390 0.74 NTRK1 (0.52) HPGDCRHR1CRHR2PDK2NTRK1
SCHEMBL24665391 0.69 HRH3 (0.56) HPGDCRHR1NTRK1
SCHEMBL19541088 0.68 PDK2 (0.68) HPGDCRHR1PDK2NTRK1
SCHEMBL24665392 0.65 HRH3 (0.42) CRHR1PDK2NTRK1SLC6A9
SCHEMBL24665396 0.65 HRH3 (0.42) CRHR1PDK2NTRK1SLC6A9
SCHEMBL22845271 0.64 HPGD (0.62) HPGDCRHR1NTRK1
SCHEMBL21434759 0.63 MAPT (0.62) HPGDTRPV1SLC6A9
SCHEMBL4357462 0.63 AVPR2 (0.50) HPGDTRPV1
SCHEMBL27693676 0.63 MAPT (0.42) HPGDCRHR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11787769-B2 Inhibitors of influenza viral entry THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2023-10-17 — — US disclosed
US-20220267275-A1 Inhibitors of Influenza Viral Entry NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2022-08-25 — — 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 (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-11787769-B2 Inhibitors of influenza viral entry NAAA, AADAC, FURIN HPGD 1299/4885CRHR1 3524/4885CRHR2 3832/4885
US-20220267275-A1 Inhibitors of Influenza Viral Entry NAAA, AADAC, FURIN HPGD 1299/4885CRHR1 3524/4885CRHR2 3832/4885

“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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