SCHEMBL5783183

SCHEMBL5783183

CCOc1cc2c(cc1OCC)NC(=O)C2

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 1/20 0.51
CYP19A1 P11511 1/20 0.45
CYP11B1 P15538 1/20 0.45
CYP11B2 P19099 1/20 0.45
EIF2AK2 P19525 1/20 0.45
ACHE P22303 1/20 0.44
SRC P12931 2/20 0.43
EGFR P00533 1/20 0.43
KMT2A Q03164 1/20 0.43
AHR P35869 4/20 0.42
CMA1 P23946 2/20 0.42
MAPK1 P28482 2/20 0.41
ALDH1A1 P00352 1/20 0.41
TSHR P16473 1/20 0.41
RECQL P46063 1/20 0.41
MAOB P27338 3/20 0.40
TP53 P04637 1/20 0.40
MAPT P10636 1/20 0.39
PDK2 Q15119 1/20 0.39

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
SCHEMBL12431388 0.82 TRPV4 (0.43) S1PR1CYP19A1CYP11B1CYP11B2EIF2AK2
SCHEMBL578508 0.80 SRC (0.57) EIF2AK2SRCEGFRKMT2AAHR
SCHEMBL12431382 0.79 TP53 (0.41) S1PR1CYP19A1CYP11B1CYP11B2KMT2A
SCHEMBL689457 0.77 MAOB (0.62) EIF2AK2SRCKMT2AAHRMAOB
SCHEMBL12431389 0.77 EIF2AK2 (0.68) S1PR1EIF2AK2KMT2AAHRCMA1
SCHEMBL6587380 0.77 SRC (0.45) EIF2AK2SRCEGFRKMT2AAHR
SCHEMBL31010750 0.74 AHR (0.59) CYP11B1CYP11B2EIF2AK2AHRCMA1
SCHEMBL10714519 0.73 PDE3B (0.57) CYP11B1CYP11B2EIF2AK2AHRMAOB
SCHEMBL6078702 0.72 S1PR1 (0.53) S1PR1CYP19A1CYP11B1CYP11B2EIF2AK2
SCHEMBL24465258 0.72 MAPT (0.52) ACHEKMT2AMAPK1ALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1212318-B1 SUBSTITUTED INDOLINONES AS TYROSINE KINASE INHIBITORS BOEHRINGER INGELHEIM PHARMA (DE) 2006-01-25 EP disclosed
US-20050009898-A1 New substituted indolinones, their manufacture and their use as medicaments BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2005-01-13 US disclosed
US-6794395-B1 Substituted indolinones, their manufacture and their use as medicaments BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2004-09-21 US 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-20050009898-A1 New substituted indolinones, their manufacture and their use as medicaments CCNE1, CDK1, CCNI S1PR1 1581/4885CYP19A1 168/4885CYP11B1 173/4885

“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.