SCHEMBL4327538

SCHEMBL4327538

Cc1nc(C(=O)CC(=O)c2ccccc2)cs1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HIF1A Q16665 2/20 0.56
▸ MAPT P10636 3/20 0.55
▸ MEN1 O00255 2/20 0.55
▸ KMT2A Q03164 2/20 0.55
▸ CYP3A4 P08684 2/20 0.55
▸ HPGD P15428 2/20 0.55
▸ KDM4E B2RXH2 2/20 0.55
▸ SMN1; SMN2 Q16637 2/20 0.55
▸ ALOX15 P16050 1/20 0.55
▸ CES1 P23141 1/20 0.55
▸ MAPK1 P28482 1/20 0.55
▸ TDP1 Q9NUW8 1/20 0.55
▸ NPC1 O15118 4/20 0.54
▸ RAB9A P51151 4/20 0.54
▸ TLR7 Q9NYK1 3/20 0.52
▸ PLOD2 O00469 2/20 0.50
▸ PLOD3 O60568 1/20 0.50
▸ ALDH1A1 P00352 1/20 0.50
▸ CYP1A2 P05177 1/20 0.50
▸ CYP2D6 P10635 1/20 0.50

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
SCHEMBL7082319 0.85 HIF1A (0.52) HIF1AMAPTMEN1KMT2ASMN1; SMN2
SCHEMBL13475954 0.81 TLR7 (0.53) HIF1AMAPTMEN1KMT2AHPGD
Dibenzoylmethane SCHEMBL28976284 0.76 MEN1 (0.94) HIF1AMAPTMEN1KMT2ACYP3A4
SCHEMBL18844093 0.75 MEN1 (0.68) HIF1AMAPTMEN1KMT2ACYP3A4
SCHEMBL14982176 0.74 MEN1 (0.55) HIF1AMAPTMEN1KMT2ACYP3A4
SCHEMBL14014056 0.74 TDP1 (0.66) HIF1AMAPTMEN1KMT2AHPGD
Dibenzoylmethane SCHEMBL39582 0.74 MEN1 (1.00) HIF1AMAPTMEN1KMT2ACYP3A4
Dibenzoylmethane SCHEMBL10356288 0.74 MEN1 (1.00) HIF1AMAPTMEN1KMT2ACYP3A4
Dibenzoylmethane SCHEMBL1704711 0.74 MEN1 (1.00) HIF1AMAPTMEN1KMT2ACYP3A4
SCHEMBL2643079 0.73 RAB9A (0.47) HIF1AMAPTMEN1KMT2AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7569688-B2 Propane-1, 3-dione derivative ASTELLAS PHARMA INC. (JP) 2009-08-04 — — US disclosed
EP-1300398-B1 PROPANE-1,3-DIONE DERIVATIVES ASTELLAS PHARMA INC (JP) 2006-04-05 — — EP disclosed
US-20050267110-A1 Propane-1, 3-dione derivative YAMANOUCHI PHARMACEUTICAL CO., LTD. 2005-12-01 — — US disclosed
US-6960591-B2 Propane-1,3-dione derivative YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 2005-11-01 — — US disclosed
US-20030191164-A1 Propane-1,3-dione derivatives ASTELLAS PHARMA INC. (JP) 2003-10-09 — — US disclosed
EP-1300398-A1 PROPANE-1,3-DIONE DERIVATIVES YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 2003-04-09 — — EP 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-20030191164-A1 Propane-1,3-dione derivatives GNRHR, GPER1, FSHR HIF1A 979/4885MAPT 2864/4885MEN1 1312/4885
US-20050267110-A1 Propane-1, 3-dione derivative GNRHR, GPER1, FSHR HIF1A 988/4885MAPT 3016/4885MEN1 1282/4885

“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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