SCHEMBL2230698

SCHEMBL2230698

CCc1cccc(N2CCCN(c3ccc(NC(=O)C(=O)c4c(-c5ccccc5)cc5ccccn45)cc3)CC2)n1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.49
ALDH1A1 P00352 5/20 0.49
LMNA P02545 3/20 0.49
SMN1; SMN2 Q16637 3/20 0.49
THRB P10828 1/20 0.49
HTT P42858 3/20 0.48
L3MBTL1 Q9Y468 1/20 0.45
KMT2A Q03164 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
CNR1 P21554 3/20 0.38
DNM1L O00429 1/20 0.37
KCNQ2 O43526 1/20 0.35
REV1 Q9UBZ9 1/20 0.35
GAA P10253 2/20 0.35
POLB P06746 1/20 0.35
HSD17B10 Q99714 1/20 0.35

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
SCHEMBL1645951 0.98 THRB (0.52) MAPTALDH1A1LMNASMN1; SMN2THRB
SCHEMBL1645436 0.90 L3MBTL1 (0.49) MAPTALDH1A1LMNASMN1; SMN2THRB
SCHEMBL1646860 0.90 ALDH1A1 (0.52) MAPTALDH1A1LMNASMN1; SMN2THRB
SCHEMBL1646057 0.87 ALDH1A1 (0.54) MAPTALDH1A1LMNASMN1; SMN2THRB
SCHEMBL1645450 0.87 MAPT (0.41) MAPTALDH1A1LMNASMN1; SMN2THRB
SCHEMBL1648701 0.85 ALDH1A1 (0.50) MAPTALDH1A1LMNASMN1; SMN2THRB
SCHEMBL1646661 0.85 THRB (0.49) MAPTALDH1A1LMNASMN1; SMN2THRB
SCHEMBL1646843 0.85 BDKRB1 (0.38) MAPTALDH1A1LMNASMN1; SMN2THRB
SCHEMBL1646559 0.85 KMT2A (0.38) MAPTALDH1A1LMNASMN1; SMN2THRB
SCHEMBL2233150 0.84 BDKRB1 (0.39) MAPTALDH1A1LMNASMN1; SMN2THRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2097413-B1 2-[(2-SUBSTITUTED)-IND0LIZIN-3-YL]-2-OXO-ACETAMIDE DERIVATIVES AS ANTIFUNGAL AGENTS F2G LTD (GB) 2013-12-25 EP disclosed
US-8604029-B2 2-[(2-substituted)-indolizin-3-yl]-2-oxo-acetamide derivatives as antifungal agents F2G LTD BRITISH BODY CORPORATE (GB) 2013-12-10 US disclosed
US-20110183969-A1 ANTIFUNGAL COMBINATION THERAPY F2G LTD (GB) 2011-07-28 US disclosed
US-20100056511-A1 2- [ (2-SUBSTITUTED) -IND0LIZIN-3-YL] -2-OXO-ACETAMIDE DERIVATIVES AS ANTIFUNGAL AGENTS F2G LTD. 2010-03-04 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 (2 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-20110183969-A1 ANTIFUNGAL COMBINATION THERAPY IDO1, FOXM1, IPO5 MAPT 1771/4885ALDH1A1 2813/4885LMNA 3870/4885
US-20100056511-A1 2- [ (2-SUBSTITUTED) -IND0LIZIN-3-YL] -2-OXO-ACETAMIDE DERIVATIVES AS ANTIFUNGAL AGENTS NAT1, AGXT, CYP1A2 MAPT 2950/4885ALDH1A1 318/4885LMNA 1805/4885

“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.