SCHEMBL4147334

SCHEMBL4147334

Cc1ccc(C(=O)Nc2ccccc2)c(C)c1

nearest known ligand 0.72

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GPR27 Q9NS67 2/20 0.72
AVPR2 P30518 1/20 0.72
HPGD P15428 2/20 0.69
KMT2A Q03164 4/20 0.65
MEN1 O00255 2/20 0.64
TDP1 Q9NUW8 1/20 0.62
POLB P06746 1/20 0.62
ALDH1A1 P00352 3/20 0.61
KDM4E B2RXH2 2/20 0.61
GLA P06280 1/20 0.61
MAPT P10636 1/20 0.61
MCL1 Q07820 1/20 0.61
RAB9A P51151 3/20 0.57
NPC1 O15118 2/20 0.57
KCNK3 O14649 2/20 0.56
KCNK9 Q9NPC2 2/20 0.56
MAOB P27338 2/20 0.56
F12 P00748 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.55

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
SCHEMBL19501647 0.94 AVPR2 (0.70) GPR27AVPR2HPGDKMT2AMEN1
SCHEMBL19491370 0.91 POLB (0.64) GPR27AVPR2HPGDKMT2AMEN1
SCHEMBL19491395 0.87 KMT2A (0.70) GPR27AVPR2HPGDKMT2AMEN1
SCHEMBL14112955 0.86 HPGD (0.69) GPR27AVPR2HPGDKMT2AMEN1
SCHEMBL8770871 0.85 ALDH1A1 (0.63) GPR27AVPR2KMT2AMEN1TDP1
SCHEMBL14514566 0.85 PLG (0.67) GPR27AVPR2HPGDKMT2AMEN1
SCHEMBL8235539 0.85 KMT2A (0.63) GPR27AVPR2KMT2AMEN1POLB
SCHEMBL5583049 0.85 ALDH1A1 (0.69) GPR27AVPR2HPGDKMT2AMEN1
SCHEMBL19350786 0.83 GPR27 (0.74) GPR27AVPR2HPGDKMT2AMEN1
SCHEMBL30192798 0.83 TYK2 (0.67) GPR27AVPR2KMT2APOLBALDH1A1

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-20090131657-A1 PROCESS FOR ALKENYLATING CARBOXAMIDES BASF SE (DE) 2009-05-21 US disclosed
EP-1277726-B1 PROCESS FOR THE PREPARATION OF 2-HALOBENZOIC ACIDS NIHON NOHYAKU CO LTD (JP) 2007-01-03 EP disclosed
US-7057067-B2 Process for the preparation of 2-halobenzoic acids NIHON NOHYAKU CO., LTD. (JP) 2006-06-06 US disclosed
US-20030181759-A1 Process for the preparation of 2-halobenzoic acids NIHON NOHYAKU CO., LTD. (JP) 2003-09-25 US disclosed
US-6555663-B1 Pharmaceuticals which are activated intracellularly by reaction with cellular electron carriers or free radicals to cause release of a free and active drug molecule MILLS RANDELL LEE (US) 2003-04-29 US disclosed
EP-1277726-A1 PROCESS FOR THE PREPARATION OF 2-HALOBENZOIC ACIDS Nihon Nohyaku Co., Ltd. (JP) 2003-01-22 EP disclosed
EP-0414730-B1 Chemical Compounds and pharmaceutical compositions capable of releasing a drug MILLS RANDELL L (US) 1999-12-15 EP disclosed
US-5773592-A COMPRISES A CHEMILUMINESCENT MOIETY, A PHOTOCHROMIC MOIETY AND A BIOLOGICALLY ACTIVE AGENT CAPABLE OF BEING RELEASED MILLS RANDELL LEE (US) 1998-06-30 US disclosed
US-5428163-A Luminides; chemiluminescence; redox system, releasing free drug MILLS RANDELL L (US) 1995-06-27 US disclosed
EP-0414730-A4 LUMINIDE AND MACROLUMINIDE CLASS OF PHARMACEUTICALS 1993-06-16 EP disclosed
EP-0414730-A1 LUMINIDE AND MACROLUMINIDE CLASS OF PHARMACEUTICALS Mills, Randell L. (US) 1991-03-06 EP disclosed
WO-1989009833-A1 LUMINIDE AND MACROLUMINIDE CLASS OF PHARMACEUTICALS MILLS RANDELL L (US) 1989-10-19 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 (2 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-20030181759-A1 Process for the preparation of 2-halobenzoic acids HAO2, CBR1, AOC2 GPR27 1245/4885AVPR2 1753/4885HPGD 1631/4885
US-20090131657-A1 PROCESS FOR ALKENYLATING CARBOXAMIDES PRMT5, CYC1, CBR3 GPR27 4696/4885AVPR2 2571/4885HPGD 3495/4885

“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.