SCHEMBL5926432

SCHEMBL5926432

CC(NC(=O)c1cc2ccccc2cn1)C(=O)O

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.60
▸ KMT2A Q03164 3/20 0.60
▸ KDM4C Q9H3R0 1/20 0.56
▸ EGLN1 Q9GZT9 3/20 0.52
▸ ALDH1A1 P00352 1/20 0.51
▸ EGFR P00533 2/20 0.46
▸ APOBEC3G Q9HC16 1/20 0.45
▸ BBOX1 O75936 2/20 0.45
▸ FTO Q9C0B1 1/20 0.45
▸ MAP3K5 Q99683 1/20 0.45
▸ AKR1B1 P15121 2/20 0.43
▸ CCKAR P32238 1/20 0.43
▸ CBLB Q13191 1/20 0.43
▸ GRN P28799 1/20 0.43
▸ SORT1 Q99523 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
SCHEMBL14883271 0.78 EGLN1 (0.56) EGLN1ALDH1A1EGFRMAP3K5
SCHEMBL6368422 0.78 PYGL (0.51) EGLN1GRNSORT1
SCHEMBL27755828 0.78 KDM4C (0.45) MEN1KMT2AKDM4CEGLN1
SCHEMBL7332048 0.77 ITGB2 (0.50) MEN1KMT2AEGLN1ALDH1A1EGFR
SCHEMBL27467115 0.77 CHRNA7 (0.46) MEN1KMT2AEGLN1APOBEC3GMAP3K5
SCHEMBL4560488 0.76 EGLN1 (0.49) EGLN1EGFRMAP3K5CBLB
SCHEMBL27482350 0.76 EGLN1 (0.46) MEN1KMT2AEGLN1MAP3K5CBLB
SCHEMBL14876092 0.76 EGLN1 (0.57) EGLN1EGFR
SCHEMBL18642513 0.76 GCG (0.48) MEN1KMT2AALDH1A1MAP3K5
SCHEMBL28216268 0.76 GCG (0.48) MEN1KMT2AALDH1A1MAP3K5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101137650-A 2- [ isoquinoline-S-carbonyl ] amino ] -propionic acid derivatives as inhibitors of factors XI and IX for the treatment of thrombosis TRANSTECH PHARMA INC (US) 2008-03-05 — — CN disclosed
US-20060276518-A1 Aryl and heteroaryl compounds and methods to modulate coagulation TRANSTECH PHARMA, INC. 2006-12-07 — — US disclosed
US-7122580-B2 Aryl and heteroaryl compounds and methods to modulate coagulation TRANSTECH PHARMA, INC. (US) 2006-10-17 — — 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-20060276518-A1 Aryl and heteroaryl compounds and methods to modulate coagulation TFPI, F9, F2 MEN1 3448/4885KMT2A 2112/4885KDM4C 1508/4885

“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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