SCHEMBL31359945

SCHEMBL31359945

O=C(NCc1cccc(F)c1)C1[C@H]2CNC[C@@H]12

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MC4R P32245 1/20 0.49
▸ SRC P12931 1/20 0.47
▸ RAB9A P51151 2/20 0.46
▸ SSTR4 P31391 2/20 0.46
▸ MAPK1 P28482 1/20 0.46
▸ POLB P06746 1/20 0.44
▸ CHRM3 P20309 1/20 0.43
▸ HTR2C P28335 1/20 0.43
▸ HTR2B P41595 1/20 0.43
▸ MCHR1 Q99705 1/20 0.43
▸ ALDH1A1 P00352 2/20 0.43
▸ LMNA P02545 1/20 0.43
▸ HPGD P15428 1/20 0.43
▸ THRB P10828 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
SCHEMBL25155872 1.00 MC4R (0.49) MC4RSRCRAB9ASSTR4MAPK1
SCHEMBL25156474 0.81 HTR2C (0.58) MC4RSRCRAB9AMAPK1POLB
SCHEMBL25156178 0.81 ALDH1A1 (0.56) SRCPOLBCHRM3HTR2CHTR2B
SCHEMBL29583269 0.81 ALDH1A1 (0.56) SRCPOLBCHRM3HTR2CHTR2B
SCHEMBL25155624 0.78 SRC (0.53) SRCRAB9AMAPK1POLBCHRM3
SCHEMBL31359854 0.78 SRC (0.53) SRCRAB9AMAPK1POLBCHRM3
SCHEMBL5392713 0.77 ALDH1A1 (0.68) SRCPOLBALDH1A1HPGDTHRB
SCHEMBL31359953 0.75 GPR119 (0.52) SSTR4MCHR1ALDH1A1THRB
SCHEMBL25155871 0.75 GPR119 (0.52) SSTR4MCHR1ALDH1A1THRB
SCHEMBL30344314 0.75 GPR119 (0.52) SSTR4MCHR1ALDH1A1THRB

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-20250025443-A1 COMPOUNDS AND METHODS FOR TREATING CORONA VIRUSES Clear Creek Bio, Inc. (US) 2025-01-23 — — 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-20250025443-A1 COMPOUNDS AND METHODS FOR TREATING CORONA VIRUSES ACE, PREP, PEPD MC4R 4333/4885SRC 2595/4885RAB9A 3136/4885

“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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