SCHEMBL10243835

SCHEMBL10243835

Cc1[nH]c2ccc(C(=O)N3[C@@H]4CC[C@H]3C[C@@H](c3ccc(F)cc3)C4)cc2c1C

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 4/20 0.56
MAPT P10636 2/20 0.54
NPC1 O15118 4/20 0.50
RAB9A P51151 3/20 0.50
GFER P55789 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
KMT2A Q03164 2/20 0.46
KDM4E B2RXH2 1/20 0.46
ALDH1A1 P00352 1/20 0.46
THRB P10828 1/20 0.46
HPGD P15428 1/20 0.46
MEN1 O00255 1/20 0.46
TP53 P04637 1/20 0.43
HSP90AA1 P07900 1/20 0.42
HCRTR1 O43613 1/20 0.42
PKM P14618 1/20 0.42
HRH3 Q9Y5N1 1/20 0.41
SLC18A3 Q16572 1/20 0.41
SIGMAR1 Q99720 1/20 0.41
CCNC P24863 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
SCHEMBL17350727 1.00 POLB (0.56) POLBMAPTNPC1RAB9AGFER
SCHEMBL17350881 0.92 POLB (0.46) POLBMAPTNPC1RAB9AGFER
SCHEMBL10243555 0.92 POLB (0.46) POLBMAPTNPC1RAB9AGFER
SCHEMBL17350637 0.82 HSD11B1 (0.42) POLBHRH3SLC18A3SIGMAR1CCNC
SCHEMBL10243665 0.82 HSD11B1 (0.42) POLBHRH3SLC18A3SIGMAR1CCNC
SCHEMBL10243760 0.80 SLC18A3 (0.46) POLBNPC1RAB9AKMT2AKDM4E
SCHEMBL17351080 0.80 SLC18A3 (0.46) POLBNPC1RAB9AKMT2AKDM4E
SCHEMBL10243746 0.80 SLC18A3 (0.47) POLBNPC1RAB9AKMT2AKDM4E
SCHEMBL17351011 0.80 SLC18A3 (0.47) POLBNPC1RAB9AKMT2AKDM4E
SCHEMBL17350984 0.79 POLB (0.57) POLBNPC1RAB9AKMT2AKDM4E

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
EP-2318403-B1 Aryl- and heteroarylcarbonyl derivatives of substituted nortropanes, medicaments containing such compounds and their use BOEHRINGER INGELHEIM INT (DE) 2015-12-23 EP disclosed
US-20120115853-A1 Aryl- and Heteroarylcarbonyl derivatives of substituted nortropanes, medicaments containing such compounds and their use BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-05-10 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-20120115853-A1 Aryl- and Heteroarylcarbonyl derivatives of substituted nortropanes, medicaments containing such compounds and their use HSD11B1, HSD11B2, HSD17B1 POLB 2353/4885MAPT 4658/4885NPC1 136/4885

“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.