SCHEMBL923398

SCHEMBL923398

COc1cccc(Nc2nc(C3CC3)nc3sc4ccccc4c23)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPAS1 Q99814 1/20 0.52
IDO1 P14902 1/20 0.48
ABCG2 Q9UNQ0 7/20 0.44
MEN1 O00255 4/20 0.44
KMT2A Q03164 4/20 0.44
KDR P35968 3/20 0.44
DYRK3 O43781 1/20 0.44
MAP4K4 O95819 1/20 0.44
EGFR P00533 1/20 0.44
PDGFRA P16234 1/20 0.44
LTK P29376 1/20 0.44
GRK5 P34947 1/20 0.44
MAPK8 P45983 1/20 0.44
CDK8 P49336 1/20 0.44
CDK7 P50613 1/20 0.44
IRAK1 P51617 1/20 0.44
NEK4 P51957 1/20 0.44
LIMK1 P53667 1/20 0.44
ACVR1 Q04771 1/20 0.44
TNK2 Q07912 1/20 0.44

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
SCHEMBL924677 0.84 PDE5A (0.43) EPAS1ABCG2MEN1KMT2AEGFR
SCHEMBL923315 0.84 PDE5A (0.41) EPAS1ABCG2MEN1KMT2AEGFR
SCHEMBL923415 0.84 EPAS1 (0.49) EPAS1ABCG2KDREGFRABCB1
SCHEMBL923119 0.84 MAPT (0.44) ABCG2MEN1KMT2AKDRDYRK3
SCHEMBL923231 0.80 MKNK1 (0.67) EGFRRAB9ANPC1SMN1; SMN2ALDH1A1
SCHEMBL12903928 0.69 ELANE (0.36) MEN1KMT2ARAB9AHTTNPC1
SCHEMBL20712211 0.68 IDO1 (0.64) EPAS1IDO1ABCG2MEN1KMT2A
SCHEMBL7179082 0.68 PDE5A (0.44) PDE5A
SCHEMBL6766837 0.67 MAPK1 (0.38) MEN1KMT2ARAB9ALMNAALDH1A1
SCHEMBL6743866 0.67 MAPK1 (0.38) MEN1KMT2ARAB9ANPC1LMNA

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-8802849-B2 Tricyclic benzo[4,5]thieno-[2,3-d]pyrimidine-4-yl-amin derivatives, their salts, process for producing the compounds and their pharmaceutical use VICHEM CHEMIE KUTATÓ KFT. (HU) 2014-08-12 US claimed
US-20110015214-A1 TRICYCLIC BENZO[4,5]THIENO-[2,3-D]PYRIMIDINE-4-YL-AMIN DERIVATIVES, THEIR SALTS, PROCESS FOR PRODUCING THE COMPOUNDS AND THEIR PHARMACEUTICAL USE VICHEM CHEMIE KUTATO KFT. (HU) 2011-01-20 US claimed
EP-2257554-A1 TRICYCLIC BENZOÝ4,5¨THIENO-Ý2,3-D¨PYRIMIDINE-4-YL-AMIN DERIVATIVES, THEIR SALTS, PROCESS FOR PRODUCING THE COMPOUNDS AND THEIR PHARMACEUTICAL USE Vichem Chemie Kutató KFT (HU) 2010-12-08 EP claimed
WO-2009104026-A1 TRICYCLIC BENZO[4,5]THIENO-[2,3-D]PYRIMIDINE-4-YL-AMIN DERIVATIVES, THEIR SALTS, PROCESS FOR PRODUCING THE COMPOUNDS AND THEIR PHARMACEUTICAL USE VICHEM CHEMIE KUTATÓ KFT (HU) 2009-08-27 WO claimed
US-8802849-B2 Tricyclic benzo[4,5]thieno-[2,3-d]pyrimidine-4-yl-amin derivatives, their salts, process for producing the compounds and their pharmaceutical use VICHEM CHEMIE KUTATÓ KFT. (HU) 2014-08-12 US disclosed
US-20110015214-A1 TRICYCLIC BENZO[4,5]THIENO-[2,3-D]PYRIMIDINE-4-YL-AMIN DERIVATIVES, THEIR SALTS, PROCESS FOR PRODUCING THE COMPOUNDS AND THEIR PHARMACEUTICAL USE VICHEM CHEMIE KUTATO KFT. (HU) 2011-01-20 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-20110015214-A1 TRICYCLIC BENZO[4,5]THIENO-[2,3-D]PYRIMIDINE-4-YL-AMIN DERIVATIVES, THEIR SALTS, PROCESS FOR PRODUCING THE COMPOUNDS AND THEIR PHARMACEUTICAL USE TYMS, TYMP, DPYD EPAS1 3624/4885IDO1 1293/4885ABCG2 17/4885

“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.