SCHEMBL17060232

SCHEMBL17060232

Cc1cc(-c2ncc(-c3cccnc3)cc2/C=C/c2ccccc2)cnc1-c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 2/20 0.43
CYP11B2 P19099 2/20 0.43
CYP2A6 P11509 3/20 0.43
CHEK1 O14757 1/20 0.41
ALDH1A1 P00352 4/20 0.40
RAB9A P51151 3/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
CASP3 P42574 1/20 0.40
SENP8 Q96LD8 1/20 0.40
SENP7 Q9BQF6 1/20 0.40
SENP6 Q9GZR1 1/20 0.40
HPGDS O60760 1/20 0.40
ALOX5 P09917 1/20 0.39
PTGS1 P23219 1/20 0.39
PTGS2 P35354 1/20 0.39
NPC1 O15118 2/20 0.39
PDGFRB P09619 2/20 0.38
PDGFRA P16234 2/20 0.38
RAF1 P04049 1/20 0.38

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
SCHEMBL17060234 1.00 CYP11B1 (0.43) CYP11B1CYP11B2CYP2A6CHEK1ALDH1A1
SCHEMBL29695665 0.98 CYP2A6 (0.46) CYP11B1CYP11B2CYP2A6CHEK1ALDH1A1
SCHEMBL17060302 0.98 CYP2A6 (0.46) CYP11B1CYP11B2CYP2A6CHEK1ALDH1A1
SCHEMBL17060301 0.98 CYP2A6 (0.46) CYP11B1CYP11B2CYP2A6CHEK1ALDH1A1
SCHEMBL17060265 0.95 CYP2A6 (0.46) CYP11B1CYP11B2CYP2A6CHEK1ALDH1A1
SCHEMBL17060264 0.95 CYP2A6 (0.46) CYP11B1CYP11B2CYP2A6CHEK1ALDH1A1
SCHEMBL23812650 0.91 NPY5R (0.40) CYP11B1CYP11B2CYP2A6CHEK1ALDH1A1
SCHEMBL30808839 0.90 CHEK1 (0.41) CYP11B1CYP11B2CYP2A6CHEK1ALDH1A1
SCHEMBL30219819 0.90 CHEK1 (0.41) CYP11B1CYP11B2CYP2A6CHEK1ALDH1A1
SCHEMBL23820025 0.90 CHEK1 (0.41) CYP11B1CYP11B2CYP2A6CHEK1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10307410-B2 Mcl-1 modulating compounds for cancer treatment CENTRE REGIONAL DE LUTTE CONTRE LE CANCER FRANCOIS BACLESSE (FR) 2019-06-04 US claimed
EP-3114119-B1 MCL-1 MODULATING COMPOUNDS FOR CANCER TREATMENT CENTRE DE LUTTE CONTRE LE CANCER FRANCOIS BACLESSE (FR) 2019-05-01 EP claimed
US-20170071921-A1 MCL-1 MODULATING COMPOUNDS FOR CANCER TREATMENT CENTRE REGIONAL DE LUTTE CONTRE LE CANCER FRANCOIS BACLESSE (FR) 2017-03-16 US claimed
EP-2915811-A1 MCL-1 modulating compounds for cancer treatment Centre Régional de Lutte contre le Cancer - Centre François Baclesse (FR) 2015-09-09 EP claimed
US-10307410-B2 Mcl-1 modulating compounds for cancer treatment CENTRE REGIONAL DE LUTTE CONTRE LE CANCER FRANCOIS BACLESSE (FR) 2019-06-04 US disclosed
US-10307410-B2 Mcl-1 modulating compounds for cancer treatment CENTRE REGIONAL DE LUTTE CONTRE LE CANCER FRANCOIS BACLESSE (FR) 2019-06-04 US disclosed
EP-3114119-B1 MCL-1 MODULATING COMPOUNDS FOR CANCER TREATMENT CENTRE DE LUTTE CONTRE LE CANCER FRANCOIS BACLESSE (FR) 2019-05-01 EP disclosed
US-20170071921-A1 MCL-1 MODULATING COMPOUNDS FOR CANCER TREATMENT CENTRE REGIONAL DE LUTTE CONTRE LE CANCER FRANCOIS BACLESSE (FR) 2017-03-16 US disclosed
US-20170071921-A1 MCL-1 MODULATING COMPOUNDS FOR CANCER TREATMENT CENTRE REGIONAL DE LUTTE CONTRE LE CANCER FRANCOIS BACLESSE (FR) 2017-03-16 US disclosed
US-20170071921-A1 MCL-1 MODULATING COMPOUNDS FOR CANCER TREATMENT CENTRE REGIONAL DE LUTTE CONTRE LE CANCER FRANCOIS BACLESSE (FR) 2017-03-16 US disclosed
EP-2915811-A1 MCL-1 modulating compounds for cancer treatment Centre Régional de Lutte contre le Cancer - Centre François Baclesse (FR) 2015-09-09 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 (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-20170071921-A1 MCL-1 MODULATING COMPOUNDS FOR CANCER TREATMENT MCL1, BCL2A1, BCL2L1 CYP11B1 784/4885CYP11B2 1121/4885CYP2A6 3028/4885
US-10307410-B2 Mcl-1 modulating compounds for cancer treatment MCL1, BCL2A1, BCL2L1 CYP11B1 784/4885CYP11B2 1121/4885CYP2A6 3028/4885

“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.