SCHEMBL3289664

SCHEMBL3289664

CC1=Cc2sc(C)c(-c3ccccc3C)c2C1

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NISCH Q9Y2I1 1/20 0.33
HPGD P15428 1/20 0.31
LCK P06239 1/20 0.31
KDR P35968 1/20 0.31
JAK3 P52333 1/20 0.31
MAPK14 Q16539 1/20 0.31
NPC1 O15118 1/20 0.30
CASP3 P42574 1/20 0.30
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
SENP8 Q96LD8 1/20 0.30
SENP7 Q9BQF6 1/20 0.30
SENP6 Q9GZR1 1/20 0.30

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
SCHEMBL21126013 0.72 TSHR (0.43) NISCHHPGDNPC1CASP3RAB9A
SCHEMBL2964872 0.68 ALDH1A1 (0.35) NPC1CASP3RAB9ASMN1; SMN2SENP8
SCHEMBL817896 0.66
SCHEMBL29776193 0.66 BRD4 (0.35) NISCHNPC1CASP3RAB9ASMN1; SMN2
SCHEMBL4314296 0.65 LIMK1 (0.38)
SCHEMBL2961338 0.61 BRD4 (0.32) NPC1CASP3RAB9ASMN1; SMN2SENP8
SCHEMBL2974370 0.61 ALDH1A1 (0.35) NPC1CASP3RAB9ASMN1; SMN2SENP8
SCHEMBL22675051 0.61 HEXA (0.34) NISCHHPGDMAPK14NPC1CASP3
SCHEMBL14540297 0.61 LMNA (0.43) HPGDNPC1CASP3RAB9ASMN1; SMN2
SCHEMBL1133067 0.61 MYC (0.56) NPC1CASP3RAB9ASMN1; SMN2SENP8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7723450-B2 Transition metal compound, ligand system, catalyst system and process for preparing polyolefins BASELL POLYOLEFINE GMBH (DE) 2010-05-25 US disclosed
US-20070260023-A1 Transition Metal Compound, Ligand System, Catalyst System and Process for Preparing Polyolefins BASELL POLYOLEFINE GMBH (DE) 2007-11-08 US disclosed
EP-1761571-A1 TRANSITION METAL COMPOUND, LIGAND SYSTEM., CATALYST SYSTEM AND PROCESS FOR PREPARING POLYOLEFINS Basell Polyolefine GmbH (DE) 2007-03-14 EP disclosed
WO-2005118654-A1 TRANSITION METAL COMPOUND, LIGAND SYSTEM, CATALYST SYSTEM AND PROCESS FOR PREPARING POLYOLEFINS BASELL POLYOLEFINE GMBH (DE) 2005-12-15 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-20070260023-A1 Transition Metal Compound, Ligand System, Catalyst System and Process for Preparing Polyolefins ZYX, ZC3HAV1L, ZKSCAN2 NISCH 2564/4885HPGD 3782/4885LCK 762/4885

“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.