SCHEMBL8771475

SCHEMBL8771475

CC(C)(C)Cc1ccc(-n2cccc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
VHL P40337 1/20 0.55
ELOC Q15369 1/20 0.55
ELOB Q15370 1/20 0.55
POLB P06746 6/20 0.48
NSD2 O96028 1/20 0.48
GRK2 P25098 1/20 0.48
CASP6 P55212 1/20 0.48
CTDSP1 Q9GZU7 1/20 0.48
ESR1 P03372 1/20 0.48
AOC2 O75106 3/20 0.47
L3MBTL1 Q9Y468 2/20 0.45
KDM4E B2RXH2 1/20 0.45
GAA P10253 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
MEN1 O00255 5/20 0.41
KMT2A Q03164 5/20 0.41
LMNA P02545 3/20 0.41
ALDH1A1 P00352 3/20 0.41
RECQL P46063 2/20 0.41
MAPT P10636 2/20 0.41

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
SCHEMBL22013499 0.80 VHL (0.47) VHLELOCELOBPOLBNSD2
SCHEMBL1754328 0.79 AOC2 (0.51) VHLELOCELOBPOLBNSD2
SCHEMBL8341142 0.78 QPCT (0.50) VHLELOCELOBESR1KMT2A
SCHEMBL6685103 0.76 ESR1 (0.74) ESR1LMNAALDH1A1MAPTBLM
SCHEMBL9969422 0.76 LMNA (0.58) MEN1KMT2ALMNAMAPTCYP1A2
SCHEMBL6720236 0.76 BLM (0.61) VHLELOCELOBPOLBNSD2
SCHEMBL6720238 0.76 BLM (0.61) VHLELOCELOBPOLBNSD2
SCHEMBL11326181 0.76 BLM (0.61) VHLELOCELOBPOLBNSD2
SCHEMBL5603565 0.76 VHL (0.61) VHLELOCELOBPOLBNSD2
SCHEMBL20319186 0.75 VHL (0.67) VHLELOCELOBPOLBNSD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11746116-B2 Antibiotic resistance breakers KING'S COLLEGE LONDON (GB) 2023-09-05 US disclosed
US-11746116-B2 Antibiotic resistance breakers KING'S COLLEGE LONDON (GB) 2023-09-05 US disclosed
US-20160145251-A1 INHIBITORS OF MYOCARDIN-RELATED TRANSCRIPTION FACTOR AND SERUM RESPONSE FACTOR (MRTF/SRF)-MEDIATED GENE TRANSCRIPTION AND METHODS FOR USE OF THE SAME BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY 2016-05-26 US disclosed
US-8252935-B2 Piperidinyl and piperazinyl modulators of γ-secretase JANSSEN PHARMACEUTICA N.V. (BE) 2012-08-28 US disclosed
US-8252935-B2 Piperidinyl and piperazinyl modulators of γ-secretase JANSSEN PHARMACEUTICA N.V. (BE) 2012-08-28 US disclosed
US-20120129189-A1 Methods of Controlling Cell Proliferation THE J. DAVID GLADSTONE INSTITUTES 2012-05-24 US disclosed
US-7750151-B2 Inhibitors of Akt activity MERCK SHARP & DOHME CORP. (US) 2010-07-06 US disclosed
US-7750151-B2 Inhibitors of Akt activity MERCK SHARP & DOHME CORP. (US) 2010-07-06 US disclosed
US-20090105275-A1 PIPERIDINYL AND PIPERAZINYL MODULATORS OF y-SECRETASE JANSSEN PHARMACEUTICA N.V. (BE) 2009-04-23 US disclosed
US-20090105275-A1 PIPERIDINYL AND PIPERAZINYL MODULATORS OF y-SECRETASE JANSSEN PHARMACEUTICA N.V. (BE) 2009-04-23 US disclosed
US-20080280899-A1 Inhibitors of Akt Activity MERCK SHARP & DOHME CORP. 2008-11-13 US disclosed
US-20080280899-A1 Inhibitors of Akt Activity MERCK SHARP & DOHME CORP. 2008-11-13 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 (4 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-20090105275-A1 PIPERIDINYL AND PIPERAZINYL MODULATORS OF y-SECRETASE BACE1, BACE2, PSEN1 VHL 3470/4885ELOC 2523/4885ELOB 1067/4885
US-20160145251-A1 INHIBITORS OF MYOCARDIN-RELATED TRANSCRIPTION FACTOR AND SERUM RESPONSE FACTOR (MRTF/SRF)-MEDIATED GENE TRANSCRIPTION AND METHODS FOR USE OF THE SAME SREBF1, SREBF2, BPTF VHL 1816/4885ELOC 2377/4885ELOB 367/4885
US-11746116-B2 Antibiotic resistance breakers ABCC1, ARL1, AKR1C3 VHL 4460/4885ELOC 3347/4885ELOB 3503/4885
US-20080280899-A1 Inhibitors of Akt Activity AKT1, AKT2, AKT3 VHL 1767/4885ELOC 2292/4885ELOB 3104/4885

“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.