SCHEMBL837692

SCHEMBL837692

Cc1cc(Nc2ccccc2)nc2ccccc12

nearest known ligand 0.75

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.75
KMT2A Q03164 6/20 0.75
KDM4E B2RXH2 4/20 0.75
MAPT P10636 3/20 0.75
SMN1; SMN2 Q16637 3/20 0.75
RAB9A P51151 2/20 0.75
LMNA P02545 2/20 0.75
POLB P06746 1/20 0.71
ALDH1A1 P00352 1/20 0.59
HPGD P15428 1/20 0.59
PDGFRB P09619 2/20 0.57
PDGFRA P16234 2/20 0.57
CYP1A2 P05177 2/20 0.56
NPC1 O15118 1/20 0.56
SLC2A1 P11166 1/20 0.55
BACE1 P56817 1/20 0.53
KDM1A O60341 1/20 0.52
CYP2D6 P10635 1/20 0.51

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
SCHEMBL837706 0.92 MEN1 (0.74) MEN1KMT2AKDM4EMAPTSMN1; SMN2
SCHEMBL30917200 0.89 KMT2A (0.70) MEN1KMT2AKDM4EMAPTSMN1; SMN2
SCHEMBL838429 0.89 KMT2A (0.70) MEN1KMT2AKDM4EMAPTSMN1; SMN2
SCHEMBL4817753 0.89 KDM4E (0.70) MEN1KMT2AKDM4EMAPTSMN1; SMN2
SCHEMBL837756 0.86 RAB9A (0.70) MEN1KMT2AKDM4EMAPTSMN1; SMN2
SCHEMBL14420787 0.85 MEN1 (0.65) MEN1KMT2AKDM4EMAPTSMN1; SMN2
SCHEMBL11712509 0.83 KDM4E (0.65) MEN1KMT2AKDM4EMAPTSMN1; SMN2
SCHEMBL31098995 0.83 KDM4E (0.65) MEN1KMT2AKDM4EMAPTSMN1; SMN2
SCHEMBL1702071 0.82 MEN1 (0.72) MEN1KMT2AKDM4EMAPTSMN1; SMN2
SCHEMBL1702216 0.81 KDM4E (0.59) MEN1KMT2AKDM4EMAPTSMN1; SMN2

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-8143295-B2 Compounds having activity in correcting mutant-CFTR processing and uses thereof THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2012-03-27 US disclosed
US-8143295-B2 Compounds having activity in correcting mutant-CFTR processing and uses thereof THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2012-03-27 US disclosed
US-20080318984-A1 Compounds Having Activity in Correcting Mutant-Cftr Processing and Uses Thereof NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2008-12-25 US disclosed
US-20080318984-A1 Compounds Having Activity in Correcting Mutant-Cftr Processing and Uses Thereof NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2008-12-25 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-20080318984-A1 Compounds Having Activity in Correcting Mutant-Cftr Processing and Uses Thereof CFTR, ABCC5, QPCT MEN1 4634/4885KMT2A 4258/4885KDM4E 2979/4885

“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.