SCHEMBL5540868

SCHEMBL5540868

CCc1c[nH]c(C=O)c1CC

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 1/20 0.32
PIM3 Q86V86 1/20 0.32

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
SCHEMBL9539293 0.81 IGF1R (0.32)
SCHEMBL21809013 0.80
SCHEMBL18190318 0.79 LMNA (0.31)
SCHEMBL9657794 0.77
SCHEMBL9657791 0.77
SCHEMBL6438670 0.74 IGF1R (0.31)
SCHEMBL8719717 0.71 IGF1R (0.31)
SCHEMBL18190401 0.70 CDK2 (0.36)
SCHEMBL23403823 0.70 PGR (0.39)
SCHEMBL7173883 0.70 SMN1; SMN2 (0.34)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8247392-B2 Materials for selective trapping of carbon monoxide CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (C.N.R.S.) (FR) 2012-08-21 US disclosed
US-7521551-B2 Chlorins possessing fused ring systems useful as photoselective compounds for photodynamic therapy MIRAVANT PHARMACEUTICALS, INC. (US) 2009-04-21 US disclosed
US-20080275232-A1 CHLORINS POSSESSING FUSED RING SYSTEMS USEFUL AS PHOTOSELECTIVE COMPOUNDS FOR PHOTODYNAMIC THERAPY MIRAVANT PHARMACEUTICALS, INC. 2008-11-06 US disclosed
EP-1414823-B1 MATERIALS FOR SELECTIVE TRAPPING OF CARBON MONOXIDE AIR LIQUIDE (FR) 2007-05-02 EP disclosed
US-20060287195-A1 Novel materials for selective trapping of carbon minixide CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2006-12-21 US disclosed
US-7112671-B2 Non-symmetric tripyrranes in the synthesis of novel macrocycles PHARMACYCLICS, INC. (US) 2006-09-26 US disclosed
EP-1247655-B1 OPTICAL RECORDING MEDIUM AND NOVEL AZAPORPHYRIN COMPOUNDS MITSUI CHEMICALS INC (JP) 2006-05-31 EP disclosed
EP-1262966-B1 Optical recording medium and novel azaporphyrin compound MITSUI CHEMICALS INC (JP) 2006-04-12 EP disclosed
US-6969764-B2 Mono-, di-, and triazaporphyrin compounds optionally in the form of a metal or metalloid complex MITSUI CHEMICALS, INC. (JP) 2005-11-29 US disclosed
US-20030232800-A1 Non-symmetric tripyrranes in the synthesis of novel macrocycles UNIVERSITY OF TEXAS 2003-12-18 US disclosed
US-20030194646-A1 Mono-, di-, and triazaporphyrin compounds optionally in the form of a metal or metalloid complex MITSUI CHEMICALS, INC. (JP) 2003-10-16 US disclosed
EP-1262966-A2 Optical recording medium and novel azaporphyrin compound Mitsui Chemicals, Inc. (JP) 2002-12-04 EP disclosed
EP-1247655-A1 OPTICAL RECORDING MEDIUM AND NOVEL AZAPORPHYRIN COMPOUNDS Mitsui Chemicals, Inc. (JP) 2002-10-09 EP disclosed
WO-2002017925-A1 NON-SYMMETRIC TRIPYRRANNES IN THE SYNTHESIS OF NOVEL MACROCYCLES PHARMACYCLICS, INC. (US) 2002-03-07 WO disclosed
EP-0357059-A2 Electrically conductive polymer mixtures WACKER-CHEMIE GMBH (DE) 1990-03-07 EP 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 (3 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-20080275232-A1 CHLORINS POSSESSING FUSED RING SYSTEMS USEFUL AS PHOTOSELECTIVE COMPOUNDS FOR PHOTODYNAMIC THERAPY PPOX, HMBS, DDT PIM1 3399/4885PIM3 2873/4885
US-20060287195-A1 Novel materials for selective trapping of carbon minixide CBR1, CBR3, FOXM1 PIM1 1293/4885PIM3 1372/4885
US-20030232800-A1 Non-symmetric tripyrranes in the synthesis of novel macrocycles NUP188, TRIP13, NUP160 PIM1 1840/4885PIM3 2194/4885

“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.