SCHEMBL12595727

SCHEMBL12595727

Cc1ccc(-c2ccc(=O)[nH]n2)cc1C

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.66
MEN1 O00255 2/20 0.66
KMT2A Q03164 2/20 0.66
PDE4A P27815 3/20 0.59
PDE4B Q07343 3/20 0.59
PDE4C Q08493 3/20 0.59
PDE4D Q08499 3/20 0.59
PDE3B Q13370 6/20 0.56
PDE3A Q14432 6/20 0.56
ALPL P05186 1/20 0.55
CA9 Q16790 1/20 0.55
CYP1A2 P05177 2/20 0.55
TP53 P04637 2/20 0.50
CYP2C9 P11712 1/20 0.50
HPGD P15428 1/20 0.50
TSHR P16473 1/20 0.50
MAPK1 P28482 1/20 0.50
CYP2C19 P33261 1/20 0.50
BLM P54132 1/20 0.50
PMP22 Q01453 1/20 0.50

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
SCHEMBL7304379 0.86 LMNA (0.62) LMNAMEN1KMT2APDE4APDE4B
SCHEMBL11736972 0.85 LMNA (0.60) LMNAMEN1KMT2APDE4APDE4B
SCHEMBL3346610 0.85 LMNA (0.60) LMNAMEN1KMT2APDE4APDE4B
SCHEMBL11736483 0.85 LMNA (0.60) LMNAMEN1KMT2APDE4APDE4B
SCHEMBL12595734 0.85 LMNA (0.60) LMNAMEN1KMT2APDE4APDE4B
SCHEMBL11740736 0.85 LMNA (0.60) LMNAMEN1KMT2APDE4APDE4B
SCHEMBL9688064 0.85 LMNA (0.60) LMNAMEN1KMT2APDE4APDE4B
Bromide SCHEMBL11739763 0.83 LMNA (0.58) LMNAMEN1KMT2APDE4APDE4B
SCHEMBL12595802 0.82 LMNA (0.57) LMNAMEN1KMT2APDE4APDE4B
SCHEMBL12595743 0.82 PDE4A (0.78) LMNAMEN1KMT2APDE4APDE4B

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
US-9212146-B2 Substituted pyridazinones for the treatment of tumors SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES (CN) 2015-12-15 US disclosed
US-20130281426-A1 PYRIDAZINONES, THE PREPARATION METHOD AND THE USE THEREOF SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES 2013-10-24 US disclosed
US-8501731-B2 Derivatives of 6[3-(trifluoromethyl)phenyl]pyridazin-3(2H)-one having antitumor activity SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES (CN) 2013-08-06 US disclosed
US-20110112061-A1 PYRIDAZINONES, THE PREPARATION AND THE USE THEREOF SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES (CN) 2011-05-12 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-20110112061-A1 PYRIDAZINONES, THE PREPARATION AND THE USE THEREOF PDXK, PNPO, HCCS LMNA 109/4885MEN1 424/4885KMT2A 1440/4885
US-20130281426-A1 PYRIDAZINONES, THE PREPARATION METHOD AND THE USE THEREOF CYP3A5, PDXK, HCCS LMNA 89/4885MEN1 448/4885KMT2A 1495/4885

“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.