SCHEMBL23059615

SCHEMBL23059615

N#CCCN(C(=O)c1ccc(Cl)nc1)c1cccc(C(=O)Nc2c(Br)cc(C(F)(C(F)(F)F)C(F)(F)F)cc2Br)c1F

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
GPBAR1 Q8TDU6 1/20 0.34
MLYCD O95822 1/20 0.33
KCNQ3 O43525 6/20 0.33
KCNQ2 O43526 6/20 0.33
KCNE1 P15382 6/20 0.33
KCNQ1 P51787 6/20 0.33
ALDH1A1 P00352 1/20 0.32
LMNA P02545 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
SCHEMBL25085494 0.92 GPBAR1 (0.35) GPBAR1MLYCDALDH1A1LMNA
SCHEMBL23059742 0.91 GPBAR1 (0.36) GPBAR1MLYCDALDH1A1LMNA
SCHEMBL25085576 0.88 GPBAR1 (0.32) GPBAR1MLYCD
SCHEMBL25085535 0.88 GPBAR1 (0.32) GPBAR1MLYCD
SCHEMBL23059617 0.88 GPBAR1 (0.40) KMT2AGPBAR1MLYCDALDH1A1LMNA
SCHEMBL23059685 0.88 GPBAR1 (0.35) GPBAR1MLYCDALDH1A1LMNA
SCHEMBL25085565 0.88 GPBAR1 (0.33) GPBAR1MLYCDALDH1A1LMNA
SCHEMBL23059746 0.87 GPBAR1 (0.36) GPBAR1MLYCDALDH1A1LMNA
SCHEMBL23059611 0.87 GPBAR1 (0.40) GPBAR1MLYCDALDH1A1LMNA
SCHEMBL23059751 0.86 GPBAR1 (0.36) GPBAR1MLYCDALDH1A1LMNA

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-20230065544-A1 ISOPHTHALAMINDE COMPOUND AND USE THEREOF Metisa Biotechnology Co., Ltd (CN) 2023-03-02 US disclosed
WO-2021036965-A1 ISOPHTHALAMIDE COMPOUND AND USE THEREOF 沈阳化工大学 2021-03-04 WO 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 KMT2A 431/4885SMN1; SMN2 2829/4885GPBAR1 952/4885

“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.