SCHEMBL1284893

SCHEMBL1284893

CCOCc1cc2ccc(OC)cc2oc1=Nc1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 8/20 0.57
RAB9A P51151 6/20 0.57
GPR55 Q9Y2T6 1/20 0.48
KDM4E B2RXH2 7/20 0.48
MAPT P10636 5/20 0.48
ALDH1A1 P00352 5/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
AKR1B10 O60218 7/20 0.46
AKR1B1 P15121 7/20 0.46
HTT P42858 2/20 0.46
LMNA P02545 1/20 0.46
HSD17B10 Q99714 2/20 0.43
ALOX15 P16050 1/20 0.43
TSHR P16473 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
TP53 P04637 2/20 0.42
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
RXFP1 Q9HBX9 1/20 0.40
AKR1A1 P14550 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
SCHEMBL1284891 1.00 NPC1 (0.57) NPC1RAB9AGPR55KDM4EMAPT
SCHEMBL1285503 0.88 MAOB (0.49) NPC1RAB9AAKR1B10AKR1B1MEN1
SCHEMBL1285501 0.88 MAOB (0.49) NPC1RAB9AAKR1B10AKR1B1MEN1
SCHEMBL1285014 0.87 AKR1B10 (0.45) NPC1RAB9AKDM4EMAPTALDH1A1
SCHEMBL1285011 0.87 AKR1B10 (0.45) NPC1RAB9AKDM4EMAPTALDH1A1
SCHEMBL1284937 0.85 AGXT (0.40) NPC1RAB9AKDM4EMAPTALDH1A1
SCHEMBL1284938 0.85 AGXT (0.40) NPC1RAB9AKDM4EMAPTALDH1A1
SCHEMBL1284730 0.85 MAPT (0.53) NPC1RAB9AKDM4EMAPTALDH1A1
SCHEMBL1284729 0.85 MAPT (0.53) NPC1RAB9AKDM4EMAPTALDH1A1
SCHEMBL1284969 0.78 NPC1 (0.36) NPC1RAB9AKDM4EMAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8383843-B2 Method for preparing a coumarin compound, chromene compound, and method for preparing a chromene compound KAOHSIUNG MEDICAL UNIVERSITY (TW) 2013-02-26 US disclosed
US-20120088923-A1 METHOD FOR PREPARING A COUMARIN COMPOUND, CHROMENE COMPOUND, AND METHOD FOR PREPARING A CHROMENE COMPOUND KAOHSIUNG MEDICAL UNIVERSITY (TW) 2012-04-12 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 (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-20120088923-A1 METHOD FOR PREPARING A COUMARIN COMPOUND, CHROMENE COMPOUND, AND METHOD FOR PREPARING A CHROMENE COMPOUND CYP3A7, CYP2A7, F7 NPC1 548/4885RAB9A 1955/4885GPR55 2631/4885

“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.