SCHEMBL297280

SCHEMBL297280

CCNC(=O)c1cccc(C(=O)Nc2cccc(-c3nc(NC)nc4cc(OC)c(OC)cc34)c2)c1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 1/20 0.74
PDE4B Q07343 1/20 0.74
PDE4C Q08493 1/20 0.74
PDE4D Q08499 1/20 0.74
MAPT P10636 3/20 0.44
KDM4E B2RXH2 1/20 0.44
LMNA P02545 1/20 0.44
GAA P10253 1/20 0.44
HPGD P15428 1/20 0.44
HTT P42858 1/20 0.44
CTNNB1 P35222 1/20 0.44
TCF7L2 Q9NQB0 1/20 0.44
MAPK14 Q16539 2/20 0.43
EGFR P00533 1/20 0.43
ALDH1A1 P00352 1/20 0.42
LCK P06239 1/20 0.42
POLB P06746 5/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
PGK1 P00558 1/20 0.41

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
SCHEMBL371262 0.95 PDE4A (0.81) PDE4APDE4BPDE4CPDE4DMAPT
SCHEMBL296780 0.93 PDE4A (0.72) PDE4APDE4BPDE4CPDE4DMAPT
SCHEMBL12621401 0.92 PDE4A (0.64) PDE4APDE4BPDE4CPDE4DMAPT
SCHEMBL296482 0.91 PDE4A (0.79) PDE4APDE4BPDE4CPDE4DMAPT
SCHEMBL371380 0.90 PDE4A (0.78) PDE4APDE4BPDE4CPDE4DMAPT
SCHEMBL12513023 0.90 PDE4A (0.88) PDE4APDE4BPDE4CPDE4DMAPT
SCHEMBL12654371 0.90 PDE4A (0.75) PDE4APDE4BPDE4CPDE4DMAPT
SCHEMBL296765 0.89 PDE4A (0.85) PDE4APDE4BPDE4CPDE4DKDM4E
SCHEMBL296879 0.89 PDE4A (0.79) PDE4APDE4BPDE4CPDE4DMAPT
SCHEMBL295669 0.88 PDE4A (0.75) PDE4APDE4BPDE4CPDE4DMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10357495-B2 Topical formulations of PDE-4 inhibitors and their methods of use Dermavant Sciences GmbH (CH) 2019-07-23 US disclosed
US-20190134036-A1 TOPICAL FORMULATIONS OF PDE-4 INHIBITORS AND THEIR METHODS OF USE Dermavant Sciences GmbH (CH) 2019-05-09 US disclosed
EP-3463366-A1 TOPICAL FORMULATIONS OF PDE-4 INHIBITORS AND THEIR METHODS OF USE Dermavant Sciences GmbH (CH) 2019-04-10 EP disclosed
US-10206925-B2 Topical formulations of PDE-4 inhibitors and their methods of use EISAI R&D MANAGEMENT CO, LTD. (JP) 2019-02-19 US disclosed
WO-2017214289-A1 TOPICAL FORMULATIONS OF PDE-4 INHIBITORS AND THEIR METHODS OF USE Dermavant Sciences GmbH (CH) 2017-12-14 WO disclosed
US-20170348311-A1 TOPICAL FORMULATIONS OF PDE-4 INHIBITORS AND THEIR METHODS OF USE Dermavant Sciences GmbH (CH) 2017-12-07 US disclosed
US-8513269-B2 Preparation for external use EISAI R&D MANAGEMENT CO., LTD. (JP) 2013-08-20 US disclosed
US-8513269-B2 Preparation for external use EISAI R&D MANAGEMENT CO., LTD. (JP) 2013-08-20 US disclosed
EP-2202229-B1 NOVEL PREPARATION FOR EXTERNAL USE EISAI R&D MAN CO LTD (JP) 2012-03-14 EP disclosed
EP-1992622-B1 4-(3-BENZOYLAMINOPHENYL)-6,7-DIMETHOXY-2- METHYLAMINOQUINAZOLINE DERIVATIVE EISAI R&D MAN CO LTD (JP) 2011-07-27 EP disclosed
US-7939540-B2 4-(3-benzoylaminophenyl)-6,7-dimethoxy-2-methylaminoquinazoline derivatives EISAI R&D MANAGEMENT CO., LTD. (JP) 2011-05-10 US disclosed
US-7939540-B2 4-(3-benzoylaminophenyl)-6,7-dimethoxy-2-methylaminoquinazoline derivatives EISAI R&D MANAGEMENT CO., LTD. (JP) 2011-05-10 US disclosed
US-20110021545-A1 NOVEL PREPARATION FOR EXTERNAL USE EISAI R&D MANAGEMENT CO., LTD. (JP) 2011-01-27 US disclosed
US-20110021545-A1 NOVEL PREPARATION FOR EXTERNAL USE EISAI R&D MANAGEMENT CO., LTD. (JP) 2011-01-27 US disclosed
EP-2202229-A1 NOVEL PREPARATION FOR EXTERNAL USE Eisai R&D Management Co., Ltd. (JP) 2010-06-30 EP disclosed
EP-1992622-A1 4-(3-BENZOYLAMINOPHENYL)-6,7-DIMETHOXY-2- METHYLAMINOQUINAZOLINE DERIVATIVE Eisai R&D Management Co., Ltd. (JP) 2008-11-19 EP disclosed
EP-1992622-A1 4-(3-BENZOYLAMINOPHENYL)-6,7-DIMETHOXY-2- METHYLAMINOQUINAZOLINE DERIVATIVE Eisai R&D Management Co., Ltd. (JP) 2008-11-19 EP disclosed
US-20070299094-A1 4-(3-benzoylaminophenyl)-6,7-dimethoxy-2-methylaminoquinazoline derivatives EISAI R&D MANAGEMENT CO., LTD. 2007-12-27 US disclosed
US-20070299094-A1 4-(3-benzoylaminophenyl)-6,7-dimethoxy-2-methylaminoquinazoline derivatives EISAI R&D MANAGEMENT CO., LTD. 2007-12-27 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 (6 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-10206925-B2 Topical formulations of PDE-4 inhibitors and their methods of use PDE4A, PDE4B, PDE4C PDE4A 1/4885PDE4B 2/4885PDE4C 3/4885
US-20070299094-A1 4-(3-benzoylaminophenyl)-6,7-dimethoxy-2-methylaminoquinazoline derivatives ITCH, HRH4, HRH1 PDE4A 1280/4885PDE4B 1378/4885PDE4C 2057/4885
US-20170348311-A1 TOPICAL FORMULATIONS OF PDE-4 INHIBITORS AND THEIR METHODS OF USE PDE4A, PDE4B, PDE4C PDE4A 1/4885PDE4B 2/4885PDE4C 3/4885
US-10357495-B2 Topical formulations of PDE-4 inhibitors and their methods of use PDE4A, PDE4B, PDE4C PDE4A 1/4885PDE4B 2/4885PDE4C 3/4885
US-20190134036-A1 TOPICAL FORMULATIONS OF PDE-4 INHIBITORS AND THEIR METHODS OF USE PDE4A, PDE4B, PDE4C PDE4A 1/4885PDE4B 2/4885PDE4C 3/4885
US-20110021545-A1 NOVEL PREPARATION FOR EXTERNAL USE SLC26A4, SLC6A15, SLC6A19 PDE4A 3486/4885PDE4B 3375/4885PDE4C 3780/4885

“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.