SCHEMBL2833833

SCHEMBL2833833

COc1ccc(-c2nc3sc(C#N)c(C)c3c(=O)[nH]2)cc1OC

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 4/20 0.52
EGFR P00533 1/20 0.52
SRC P12931 1/20 0.52
GUSB P08236 1/20 0.48
ALOX5 P09917 1/20 0.45
EPHX2 P34913 1/20 0.45
CDKN1A P38936 5/20 0.44
CCNE2 O96020 1/20 0.43
CCNE1 P24864 1/20 0.43
CDK2 P24941 1/20 0.43
KDM4E B2RXH2 4/20 0.43
ALDH1A1 P00352 4/20 0.43
MCL1 Q07820 1/20 0.43
BRD4 O60885 1/20 0.42
TMIGD3 P0DMS9 1/20 0.42
ADORA1 P30542 1/20 0.42
HPGD P15428 3/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
BRAF P15056 1/20 0.42
MEN1 O00255 1/20 0.41

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
SCHEMBL2853032 0.88 CDKN1A (0.58) FGFR1EGFRSRCCDKN1AKDM4E
SCHEMBL2839683 0.85 CDKN1A (0.56) GUSBCDKN1AKDM4EALDH1A1BRD4
SCHEMBL2843704 0.83 KDM4E (0.50) FGFR1CDKN1AKDM4EALDH1A1BRD4
SCHEMBL5247699 0.82 CCNE2 (0.48) CCNE2CCNE1CDK2KDM4EALDH1A1
SCHEMBL2843024 0.81 TMIGD3 (0.46) GUSBCDKN1AKDM4EALDH1A1BRD4
SCHEMBL2837248 0.80 ALDH1A1 (0.61) KDM4EALDH1A1TMIGD3ADORA1HPGD
SCHEMBL13475911 0.80 TNKS (0.49) CDKN1AKDM4EALDH1A1TMIGD3ADORA1
SCHEMBL2838028 0.79 ALDH1A1 (0.57) KDM4EALDH1A1TMIGD3ADORA1HPGD
SCHEMBL2835633 0.79 PARP1 (0.48) KDM4EALDH1A1TMIGD3ADORA1HPGD
SCHEMBL13475914 0.79 TMIGD3 (0.45) CDKN1AKDM4EALDH1A1BRD4TMIGD3

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-7662814-B2 4-(4-Ethylpiperazin-1-yl)-5-methyl-2-phenylthieno[2,3-d]pyrimidine-6-carbonitrile; asthma, atopic dermatitis, chronic obstructive pulmonary disease, Crohn's disease, type I and type II diabetes, lymphoid leukemia and other forms of cancer, multiple sclerosis and autoimmune diseases LABORATORIOS ALMIRALL, S.A. (ES) 2010-02-16 US disclosed
US-7662814-B2 4-(4-Ethylpiperazin-1-yl)-5-methyl-2-phenylthieno[2,3-d]pyrimidine-6-carbonitrile; asthma, atopic dermatitis, chronic obstructive pulmonary disease, Crohn's disease, type I and type II diabetes, lymphoid leukemia and other forms of cancer, multiple sclerosis and autoimmune diseases LABORATORIOS ALMIRALL, S.A. (ES) 2010-02-16 US disclosed
EP-1590352-B1 4-AMINOTHIENO [2,3-d] PYRIMIDINE-6-CARBONITRILE DERIVATIVES AS PDE7 INHIBITORS ALMIRALL LAB (ES) 2007-06-27 EP disclosed
EP-1590352-B1 4-AMINOTHIENO [2,3-d] PYRIMIDINE-6-CARBONITRILE DERIVATIVES AS PDE7 INHIBITORS ALMIRALL LAB (ES) 2007-06-27 EP disclosed
US-20060229306-A1 4-Aminothieno[2,3-d]pyrimidine-6-carbonitrile derivatives as pde7 inhibitors LABORATORIOS ALMIRALL, S.A. (ES) 2006-10-12 US disclosed
WO-2004065391-A1 4-AMINOTHIENO[2,3-d]PYRIMIDINE-6-CARBONITRILE DERIVATIVES AS PDE7 INHIBITORS ALMIRALL PRODESFARMA S.A. (ES) 2004-08-05 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-20060229306-A1 4-Aminothieno[2,3-d]pyrimidine-6-carbonitrile derivatives as pde7 inhibitors PDE7B, PDE7A, PDE3A FGFR1 4167/4885EGFR 4806/4885SRC 4145/4885

“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.