SCHEMBL5689152

SCHEMBL5689152

CCC1=C(C)[CH]c2cccc(-c3ccc(CC)cc3)c21

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EDNRB P24530 1/20 0.35
EDNRA P25101 1/20 0.35
RPS6KA2 Q15349 1/20 0.34
PTAFR P25105 1/20 0.34
CCNE2 O96020 1/20 0.34
CDK4 P11802 1/20 0.34
CCND1 P24385 1/20 0.34
CCNE1 P24864 1/20 0.34
CDK2 P24941 1/20 0.34
ALDH1A1 P00352 3/20 0.33
MAPT P10636 3/20 0.33
LMNA P02545 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
NPC1 O15118 1/20 0.33
MAPK1 P28482 1/20 0.33
RAB9A P51151 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
EGFR P00533 1/20 0.33
KDM4E B2RXH2 1/20 0.33
F2 P00734 1/20 0.33

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
SCHEMBL5690207 0.87 PDCD1 (0.39) MAPTSMN1; SMN2NPC1RAB9AL3MBTL1
SCHEMBL5691597 0.84 TSHR (0.35) PTAFRALDH1A1MAPTLMNASMN1; SMN2
SCHEMBL5691739 0.82 HEXA (0.38) MAPTTP53
SCHEMBL5691202 0.77 RXRA (0.33) PTAFRALDH1A1MAPTNPC1RAB9A
SCHEMBL5084808 0.76 PDCD1 (0.40) ALDH1A1MAPTLMNASMN1; SMN2NPC1
SCHEMBL4623136 0.76 PDCD1 (0.40) ALDH1A1MAPTSMN1; SMN2NPC1MAPK1
SCHEMBL5689656 0.74 KDM4E (0.38) ALDH1A1MAPTSMN1; SMN2L3MBTL1KDM4E
SCHEMBL28755362 0.74 TSHR (0.32) PTAFRALDH1A1MAPTTDP1HPGD
SCHEMBL28501450 0.72 HSD11B1 (0.41) ALDH1A1MEN1HPGDKMT2ACTSV
SCHEMBL5689647 0.71 PDCD1 (0.35) ALDH1A1SMN1; SMN2MAPK1RAB9APDCD1

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
EP-1511755-B1 TRANSITION METAL COMPOUNDS THEIR PREPARATION AND THEIR USE IN CATALYST SYSTEMS FOR THE POLYMERIZATION AND COPOLYMERIZATION OF OLEFINS BASELL POLYOLEFINE GMBH (DE) 2006-03-08 EP disclosed
US-20050182266-A1 Transition metal componds their preparation and their use in catalyst systems for the polymerization and copolymerization of olefins BASELL POLYOLEFINE GMBH (DE) 2005-08-18 US disclosed
EP-1511755-A1 TRANSITION METAL COMPOUNDS THEIR PREPARATION AND THEIR USE IN CATALYST SYSTEMS FOR THE POLYMERIZATION AND COPOLYMERIZATION OF OLEFINS Basell Polyolefine GmbH (DE) 2005-03-09 EP disclosed
WO-2003106470-A1 TRANSITION METAL COMPOUNDS THEIR PREPARATION AND THEIR USE IN CATALYST SYSTEMS FOR THE POLYMERIZATION AND COPOLYMERIZATION OF OLEFINS BASELL POLYOLEFINE GMBH (DE) 2003-12-24 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-20050182266-A1 Transition metal componds their preparation and their use in catalyst systems for the polymerization and copolymerization of olefins YAP1, COX14, CYCS EDNRB 4544/4885EDNRA 4587/4885RPS6KA2 2249/4885

“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.