SCHEMBL17486144

SCHEMBL17486144

CC1(C)Oc2ccc(-c3ccc(-c4nc(-c5ccccc5)nc(N(c5ccccc5)c5ccccc5)n4)cn3)cc2C1(C)C

nearest known ligand 0.32

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.32
MAPT P10636 3/20 0.32
KMT2A Q03164 3/20 0.32
KDM4E B2RXH2 2/20 0.32
NPC1 O15118 1/20 0.32
POLB P06746 1/20 0.32
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
ADORA2A P29274 1/20 0.31
ADORA1 P30542 1/20 0.31
ALDH1A1 P00352 2/20 0.30
HPGD P15428 2/20 0.30
LMNA P02545 1/20 0.30
GLA P06280 1/20 0.30

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
SCHEMBL17486084 0.83 HSD17B1 (0.34) MEN1MAPTKMT2AKDM4ESMN1; SMN2
SCHEMBL17485981 0.80 RARB (0.36) MEN1MAPTKMT2AKDM4EALDH1A1
SCHEMBL17486105 0.78 MAPT (0.33) MEN1MAPTKMT2ASMN1; SMN2ALDH1A1
SCHEMBL19295151 0.78 MAPT (0.31) MEN1MAPTKMT2AKDM4EALDH1A1
SCHEMBL17486110 0.75 NPC1 (0.36) MAPTKDM4ENPC1RAB9AALDH1A1
SCHEMBL17486113 0.74 MEN1 (0.36) MEN1MAPTKMT2AKDM4ENPC1
SCHEMBL20805503 0.74 MAPT (0.30) MEN1MAPTKMT2A
SCHEMBL22202559 0.74 BACE1 (0.35)
SCHEMBL22202422 0.73 BACE1 (0.36) MEN1MAPTKMT2AKDM4EALDH1A1
SCHEMBL22202711 0.73 BACE1 (0.35)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3174890-B1 METAL COMPLEXES MERCK PATENT GMBH (DE) 2019-03-13 EP disclosed
US-9853228-B2 Metal complexes MERCK PATENT GMBH (DE) 2017-12-26 US disclosed
US-9853228-B2 Metal complexes MERCK PATENT GMBH (DE) 2017-12-26 US disclosed
US-20170250353-A1 METAL COMPLEXES MERCK PATENT GMBH (DE) 2017-08-31 US disclosed
US-20170250353-A1 METAL COMPLEXES MERCK PATENT GMBH (DE) 2017-08-31 US disclosed
WO-2016015815-A1 METAL COMPLEXES MERCK PATENT GMBH (DE) 2016-02-04 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-20170250353-A1 METAL COMPLEXES SOD1, AP1M1, AP3M1 MEN1 989/4885MAPT 1084/4885KMT2A 2922/4885

“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.