SCHEMBL5239246

SCHEMBL5239246

Clc1nc(-c2ccncc2)cs1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.59
SMN1; SMN2 Q16637 5/20 0.59
RAB9A P51151 5/20 0.59
LMNA P02545 2/20 0.59
CYP19A1 P11511 3/20 0.56
AR P10275 3/20 0.53
KMT2A Q03164 2/20 0.53
ESR1 P03372 1/20 0.53
NPC1 O15118 3/20 0.50
LOXL2 Q9Y4K0 1/20 0.50
GRM1 Q13255 1/20 0.48
CYP1A1 P04798 1/20 0.45
CYP1A2 P05177 1/20 0.45
CYP1B1 Q16678 1/20 0.45
MAPT P10636 3/20 0.45
VCP P55072 1/20 0.45
POLB P06746 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
MEN1 O00255 1/20 0.45
PARP1 P09874 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
SCHEMBL14755578 0.83 CYP19A1 (0.61) KDM4ESMN1; SMN2RAB9ALMNACYP19A1
SCHEMBL956221 0.83 ALDH1A1 (0.61) KDM4ESMN1; SMN2RAB9ALMNAAR
SCHEMBL4907429 0.79 RAB9A (0.56) KDM4ESMN1; SMN2RAB9AARKMT2A
SCHEMBL21283206 0.79 RAB9A (0.63) KDM4ESMN1; SMN2RAB9ALMNAAR
SCHEMBL534232 0.79 CYP19A1 (0.41) KDM4ESMN1; SMN2RAB9ALMNACYP19A1
SCHEMBL21283211 0.79 CYP19A1 (0.45) KDM4ESMN1; SMN2RAB9ALMNACYP19A1
SCHEMBL2493641 0.79 ALOX5 (0.58) KDM4ESMN1; SMN2RAB9ALMNAKMT2A
SCHEMBL130198 0.76 ALDH1A1 (0.69) KDM4ESMN1; SMN2RAB9ALMNACYP19A1
SCHEMBL4283884 0.75 KDM4E (1.00) KDM4ESMN1; SMN2RAB9ALMNACYP19A1
SCHEMBL14755554 0.75 CCR4 (0.48) KDM4ESMN1; SMN2RAB9ALMNACYP19A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1507776-B1 2-OXO-1,3,4-TRIHYDROQUINAZOLINYL DERIVATIVES FOR THE TREATMENT OF CELL PROLIFERATION-RELATED DISORDERS AMGEN INC (US) 2007-02-28 EP disclosed
US-7119111-B2 2-oxo-1,3,4-trihydroquinazolinyl derivatives and methods of use AMGEN, INC. (US) 2006-10-10 US disclosed
EP-1507776-A1 2-OXO-1,3,4-TRIHYDROQUINAZOLINYL DERIVATIVES FOR THE TREATMENT OF CELL PROLIFERATION-RELATED DISORDERS Amgen Inc. (US) 2005-02-23 EP disclosed
US-20030229068-A1 2-oxo-1,3,4-trihydroquinazolinyl derivatives and methods of use AMGEN INC. 2003-12-11 US disclosed
WO-2003101985-A1 2-OXO-1,3,4-TRIHYDROQUINAZOLINYL DERIVATIVES FOR THE TREATMENT OF CELL PROLIFERATION-RELATED DISORDERS AMGEN INC. (US) 2003-12-11 WO disclosed
EP-0169502-B1 2-BENZYL-4-(2-MORPHOLINO)-4-PYRIOL) THIAZOLE MERCK & CO. INC. (US) 1990-10-31 EP disclosed
US-4725606-A AUTOIMMUNE DISEASES MERCK & CO., INC. (US) 1988-02-16 US disclosed
US-4697012-A IMMUNOLOGY, ANTIINFLAMMATORY AGENTS MERCK & CO., INC. (US) 1987-09-29 US disclosed
EP-0169502-A2 2-Benzyl-4-(2-morpholino)-4-Pyriol) Thiazole MERCK & CO. INC. (US) 1986-01-29 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 (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-20030229068-A1 2-oxo-1,3,4-trihydroquinazolinyl derivatives and methods of use CASP3, BAX, BAD KDM4E 1697/4885SMN1; SMN2 318/4885RAB9A 3125/4885

“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.