SCHEMBL25085588

SCHEMBL25085588

Cc1cc(C(F)(C(F)(F)F)C(F)(F)F)cc(Br)c1NC(=O)c1cccc(NCCC#N)c1F

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 4/20 0.36
DHODH Q02127 4/20 0.34
P2RX1 P51575 1/20 0.34
PTGES O14684 4/20 0.33
F2R P25116 2/20 0.32
MAPT P10636 1/20 0.32
HTT P42858 1/20 0.32
BRAF P15056 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL25085545 0.94 RXFP1 (0.36) RXFP1DHODHP2RX1F2RSMN1; SMN2
SCHEMBL25085595 0.90 SMN1; SMN2 (0.38) RXFP1DHODHPTGESSMN1; SMN2
SCHEMBL23059687 0.89 DHODH (0.37) RXFP1DHODHP2RX1PTGESF2R
SCHEMBL25085575 0.88 DHODH (0.36) RXFP1DHODHP2RX1PTGESF2R
SCHEMBL23059688 0.87 DHODH (0.39) RXFP1DHODHPTGESF2RBRAF
SCHEMBL23059704 0.85 SMN1; SMN2 (0.36) RXFP1DHODHPTGESF2RSMN1; SMN2
SCHEMBL25085498 0.84 SMN1; SMN2 (0.36) RXFP1DHODHPTGESF2RSMN1; SMN2
SCHEMBL25085551 0.84 PTGES (0.37) RXFP1P2RX1PTGES
SCHEMBL23059718 0.83 RXFP1 (0.36) RXFP1DHODHPTGESBRAFSMN1; SMN2
SCHEMBL23059627 0.83 SMN1; SMN2 (0.39) RXFP1DHODHPTGESSMN1; SMN2

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-20230065544-A1 ISOPHTHALAMINDE COMPOUND AND USE THEREOF Metisa Biotechnology Co., Ltd (CN) 2023-03-02 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-20230065544-A1 ISOPHTHALAMINDE COMPOUND AND USE THEREOF DDT, INMT, CYP2B6 RXFP1 4724/4885DHODH 11/4885P2RX1 2468/4885

“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.