SCHEMBL4366276

SCHEMBL4366276

CCCc1nc2c(=O)ccccc2[nH]1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.44
HPGD P15428 2/20 0.43
MEN1 O00255 1/20 0.43
ALDH1A1 P00352 1/20 0.43
DDAH1 O94760 1/20 0.42
POLB P06746 1/20 0.42
PDE10A Q9Y233 1/20 0.42
HTT P42858 1/20 0.41
KDM4E B2RXH2 1/20 0.41
PARP1 P09874 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
MAPT P10636 1/20 0.40
KDM4C Q9H3R0 1/20 0.40

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
SCHEMBL1917210 0.78 MGAM (0.47) ALDH1A1
SCHEMBL10397230 0.77 PDE10A (0.57) DDAH1POLBPDE10AKDM4ESMN1; SMN2
SCHEMBL7964155 0.77 CHEK1 (0.58) KMT2AMEN1DDAH1POLBPDE10A
SCHEMBL9179087 0.77 RAB9A (0.50) KMT2AHPGDMEN1ALDH1A1PDE10A
SCHEMBL1917492 0.77 PSMB8 (0.49) HPGDDDAH1POLBHTTKDM4E
SCHEMBL9754832 0.77 ALDH1A1 (0.46) ALDH1A1DDAH1POLBPDE10AKDM4E
SCHEMBL8818793 0.76 ADORA3 (0.51)
SCHEMBL15767180 0.75 CHEK1 (0.41) HPGDDDAH1POLBPDE10AHTT
SCHEMBL9232152 0.75 KDM4E (0.38) KMT2AHPGDMEN1ALDH1A1DDAH1
SCHEMBL5110714 0.75 KDM4C (0.42) KMT2AHPGDMEN1ALDH1A1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1988091-B1 TRICYCLIC COMPOUNDS KYOWA HAKKO KIRIN CO LTD (JP) 2015-06-10 EP disclosed
US-8242151-B2 Tricyclic compounds KYOWA HAKKO KIRIN CO., LTD. (JP) 2012-08-14 US disclosed
US-20090176760-A1 TRICYCLIC COMPOUNDS KYOWA HAKKO KOGYO CO., LTD. (JP) 2009-07-09 US disclosed
EP-1988091-A1 TRICYCLIC COMPOUNDS Kyowa Hakko Kogyo Co., Ltd (JP) 2008-11-05 EP disclosed
US-5527815-A TREATMENT OF HYPERTENSION, CONGESTIVE HEART FAILURE, AND HIGH INTRAOCULAR PRESSURE KOTOBUKI SEIYAKU CO., LTD. (JP) 1996-06-18 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 (1 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-20090176760-A1 TRICYCLIC COMPOUNDS PPARG, PPARD, PPARA KMT2A 1525/4885HPGD 1680/4885MEN1 4772/4885

“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.