SCHEMBL5129155

SCHEMBL5129155

CCc1cc2c(Cl)nc(-c3ccccn3)nc2s1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.56
NPC1 O15118 2/20 0.56
RAB9A P51151 2/20 0.56
SMN1; SMN2 Q16637 2/20 0.56
ALDH1A1 P00352 2/20 0.56
MAPT P10636 1/20 0.56
AGTR1 P30556 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
ADORA2A P29274 4/20 0.53
ADORA1 P30542 3/20 0.53
METAP1 P53582 1/20 0.52
SELE P16581 2/20 0.50
VCAM1 P19320 2/20 0.50
HPGD P15428 2/20 0.46
CASP3 P42574 1/20 0.46
SENP8 Q96LD8 1/20 0.46
SENP7 Q9BQF6 1/20 0.46
SENP6 Q9GZR1 1/20 0.46
ICAM1 P05362 1/20 0.45
KDM4E B2RXH2 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
SCHEMBL7518453 0.85 METAP1 (0.57) LMNANPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL31045280 0.84 METAP1 (0.55) LMNANPC1RAB9ASMN1; SMN2MAPT
SCHEMBL5115112 0.84 METAP1 (0.55) LMNANPC1RAB9ASMN1; SMN2MAPT
SCHEMBL31044667 0.83 METAP1 (0.57) LMNANPC1RAB9ASMN1; SMN2MAPT
SCHEMBL5121550 0.83 METAP1 (0.57) LMNANPC1RAB9ASMN1; SMN2MAPT
SCHEMBL5128202 0.82 ADORA1 (0.50) LMNANPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL31044971 0.81 METAP1 (0.51) LMNANPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL5123515 0.81 METAP1 (0.51) LMNANPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL7509495 0.80 USP1 (0.46) LMNANPC1SMN1; SMN2ALDH1A1MAPT
SCHEMBL5114971 0.78 PRKCI (0.61) LMNANPC1RAB9ASMN1; SMN2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080045529-A1 Use Of Thienopyrimidines MERCK PATENT GMBH (DE) 2008-02-21 US disclosed
EP-1685136-A1 USE OF THIENOPYRIMIDINES MERCK PATENT GmbH (DE) 2006-08-02 EP disclosed
WO-2005047292-A1 USE OF THIENOPYRIMIDINES MERCK PATENT GMBH (DE) 2005-05-26 WO disclosed
US-6432950-B1 ANTICANCER AGENTS; KILLING CANCER CELLS CELL PATHWAYS 2002-08-13 US disclosed
US-6133271-A Method for inhibiting neoplastic cells and related conditions by exposure thienopyrimidine derivatives CELL PATHWAYS, INC. (US) 2000-10-17 US disclosed
US-6110920-A TREATMENT OF CARDIOVASCULAR DISORDERS AND IMPOTENCY MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2000-08-29 US disclosed
EP-0920431-A1 THIENOPYRIMIDINES MERCK PATENT GmbH (DE) 1999-06-09 EP disclosed
WO-1998006722-A1 THIENOPYRIMIDINES MERCK PATENT GMBH (DE) 1998-02-19 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-20080045529-A1 Use Of Thienopyrimidines TIE1, DPYD, TK2 LMNA 3799/4885NPC1 4863/4885RAB9A 3220/4885

“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.