SCHEMBL6402141

SCHEMBL6402141

CCCc1ccc(NC(C)=O)cc1O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.58
PKM P14618 1/20 0.53
SMN1; SMN2 Q16637 2/20 0.51
ALDH1A1 P00352 5/20 0.47
MAPT P10636 3/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
CA12 O43570 1/20 0.47
BRD4 O60885 1/20 0.47
NR1I2 O75469 1/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
MB P02144 1/20 0.47
CYP1A1 P04798 1/20 0.47
CA3 P07451 1/20 0.47
CYP3A4 P08684 1/20 0.47
RARG P13631 1/20 0.47
TSHR P16473 1/20 0.47
ALOX5AP P20292 1/20 0.47
CA4 P22748 1/20 0.47

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
SCHEMBL8590962 0.90 TYR (0.56) POLBPKMSMN1; SMN2ALDH1A1MAPT
SCHEMBL10888531 0.89 TYR (0.55) POLBPKMSMN1; SMN2ALDH1A1MAPT
SCHEMBL2855498 0.88 POLB (0.63) POLBPKMSMN1; SMN2ALDH1A1MAPT
SCHEMBL13963716 0.83 ALDH1A1 (0.51) POLBSMN1; SMN2ALDH1A1MAPTMEN1
SCHEMBL8612459 0.80 POLB (0.61) POLBPKMSMN1; SMN2ALDH1A1MAPT
SCHEMBL5837263 0.80 POLB (0.54) POLBPKMSMN1; SMN2ALDH1A1MAPT
SCHEMBL29939067 0.79 POLB (0.53) POLBPKMSMN1; SMN2ALDH1A1MAPT
SCHEMBL30780902 0.79 POLB (0.53) POLBPKMSMN1; SMN2ALDH1A1MAPT
SCHEMBL9582949 0.79 POLB (0.53) POLBPKMSMN1; SMN2ALDH1A1MAPT
SCHEMBL28026046 0.78 POLB (0.51) POLBPKMSMN1; SMN2ALDH1A1MAPT

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-3223821-A1 SUBSTITUTED PYRIDOBENZODIAZEPINONE-DERIVATIVES AND USE THEREOF Bayer Pharma Aktiengesellschaft (DE) 2017-10-04 EP disclosed
US-20170253602-A1 SUBSTITUTED PYRIDOBENZODIAZEPINONE-DERIVATIVES AND USE THEREOF BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2017-09-07 US disclosed
WO-2016083276-A1 SUBSTITUTED PYRIDOBENZODIAZEPINONE-DERIVATIVES AND USE THEREOF BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2016-06-02 WO disclosed
US-20050054629-A1 Compounds and methods of treating cell proliferative diseases EXONHIT THERAPEUTICS SA (FR) 2005-03-10 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 (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-20050054629-A1 Compounds and methods of treating cell proliferative diseases MKI67, CCNC, PCNA POLB 678/4885PKM 1419/4885SMN1; SMN2 1723/4885
US-20170253602-A1 SUBSTITUTED PYRIDOBENZODIAZEPINONE-DERIVATIVES AND USE THEREOF BDKRB2, BDKRB1, PDGFRB POLB 1103/4885PKM 577/4885SMN1; SMN2 3744/4885

“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.