SCHEMBL26762016

SCHEMBL26762016

Cc1nc2c(OC(F)F)cc(C(C)C)cc2cc1Br

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.34
PRNP P04156 1/20 0.34
MAPT P10636 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
RXFP1 Q9HBX9 1/20 0.34
CRHR1 P34998 1/20 0.34
PDE2A O00408 1/20 0.33
PDE10A Q9Y233 1/20 0.33
MBOAT4 Q96T53 1/20 0.31
BACE1 P56817 1/20 0.30

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
SCHEMBL26762018 0.84 PRNP (0.46) ALDH1A1PRNPMAPTNPSR1RXFP1
SCHEMBL26762031 0.83 PDE10A (0.33) ALDH1A1MAPTPDE2APDE10ABACE1
SCHEMBL26762032 0.81 CRHR1 (0.33) ALDH1A1PRNPMAPTNPSR1RXFP1
SCHEMBL26762014 0.77 RXRA (0.33)
SCHEMBL26579174 0.77 CA12 (0.33) ALDH1A1PRNPMAPTNPSR1RXFP1
SCHEMBL25113804 0.75 CCR1 (0.40) PDE2APDE10A
SCHEMBL26762022 0.66 ALDH1A1 (0.36) ALDH1A1PRNPMAPTNPSR1RXFP1
SCHEMBL26762030 0.64 KMO (0.32)
SCHEMBL14239582 0.63 LMNA (0.48) ALDH1A1
SCHEMBL25409520 0.63 MBOAT4 (0.38) ALDH1A1MAPTPDE2APDE10AMBOAT4

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-20230365525-A1 ANTIVIRAL COMPOUNDS ENANTA PHARMACEUTICALS, INC. 2023-11-16 US disclosed
US-20230365525-A1 ANTIVIRAL COMPOUNDS ENANTA PHARMACEUTICALS, INC. 2023-11-16 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-20230365525-A1 ANTIVIRAL COMPOUNDS ACE, ZC3HAV1, SARS1 ALDH1A1 2152/4885PRNP 267/4885MAPT 4520/4885

“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.