SCHEMBL6480145

SCHEMBL6480145

COc1ccc(COc2cc(CN)ccc2OC)cc1

nearest known ligand 0.63

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAOB P27338 3/20 0.63
CSF1R P07333 3/20 0.51
NTRK1 P04629 1/20 0.51
NTRK3 Q16288 1/20 0.51
NTRK2 Q16620 1/20 0.51
NPC1 O15118 1/20 0.50
RAB9A P51151 1/20 0.50
KDM4E B2RXH2 2/20 0.49
ALDH1A1 P00352 1/20 0.49
GAA P10253 1/20 0.49
MAPT P10636 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
APP P05067 5/20 0.49
IDO1 P14902 2/20 0.49
AGXT P21549 2/20 0.49
ATM Q13315 1/20 0.49
CCR5 P51681 1/20 0.47

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
SCHEMBL16763126 0.94 MAOB (0.63) MAOBCSF1RNTRK1NTRK3NTRK2
SCHEMBL7995084 0.88 KDM4E (0.68) MAOBCSF1RNTRK1NTRK3NTRK2
SCHEMBL3722770 0.87 MAPK1 (0.59) NPC1RAB9AKDM4EALDH1A1APP
Hydrochloric Acid SCHEMBL9416513 0.86 MAPK1 (0.58) MAOBKDM4EALDH1A1APP
SCHEMBL6489381 0.84 NPC1 (0.56) MAOBCSF1RNTRK1NTRK3NTRK2
SCHEMBL26819451 0.81 KDM4E (0.50) MAOBKDM4EALDH1A1GAAMAPT
SCHEMBL3712764 0.81 MEN1 (0.60) CSF1RNPC1RAB9AKDM4EALDH1A1
SCHEMBL44393 0.80 ATM (0.70) KDM4EALDH1A1GAAATM
SCHEMBL19409880 0.80 ATM (0.70) KDM4EALDH1A1GAAATM
SCHEMBL29535675 0.80 ATM (0.70) KDM4EALDH1A1GAAATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050154230-A1 Urea derivatives BAYER HEALTHCARE AG (DE) 2005-07-14 US disclosed
EP-1461311-A2 UREA DERIVATIVES AS VR1-ANTAGONISTS Bayer HealthCare AG (DE) 2004-09-29 EP disclosed
WO-2003055848-A2 UREA DERIVATIVES AS VR1- ANTAGONISTS BAYER HEALTHCARE AG (DE) 2003-07-10 WO 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-20050154230-A1 Urea derivatives SLC14A1, UBA1, VAT1 MAOB 2831/4885CSF1R 2067/4885NTRK1 1812/4885

“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.