SCHEMBL16065953

SCHEMBL16065953

COC1CCN(C2CCC2)CC1

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 13/20 0.39
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
KMT2A Q03164 1/20 0.36
PDE7A Q13946 1/20 0.35
ABCB1 P08183 1/20 0.35
CYP2D6 P10635 1/20 0.35
SLC18A3 Q16572 1/20 0.34
KCNH2 Q12809 1/20 0.34

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
SCHEMBL1825076 0.95 HRH3 (0.42) HRH3NPC1RAB9AKMT2APDE7A
SCHEMBL16065872 0.90 HRH3 (0.35) HRH3NPC1RAB9AKMT2APDE7A
SCHEMBL26031667 0.84 ALDH1A1 (0.40) HRH3NPC1RAB9AKMT2APDE7A
SCHEMBL8266529 0.82 HRH3 (0.38) HRH3CYP2D6KCNH2
SCHEMBL24294895 0.81 HRH3 (0.40) HRH3PDE7AABCB1CYP2D6
SCHEMBL18034123 0.81 HRH3 (0.43) HRH3ABCB1CYP2D6
SCHEMBL233141 0.80 CHRM2 (0.37) HRH3KMT2ACYP2D6
SCHEMBL5857613 0.80 HRH3 (0.34) HRH3NPC1RAB9AKMT2APDE7A
SCHEMBL23158169 0.80 CHRM2 (0.38) HRH3KCNH2
SCHEMBL17660501 0.80 HRH3 (0.40) HRH3NPC1RAB9AKMT2APDE7A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3856719-B1 COMPOUNDS AS NEURONAL HISTAMINE RECEPTOR-3 ANTAGONISTS AND USES THEREOF XWPHARMA LTD (KY) 2023-06-07 EP disclosed
US-9718825-B2 N-(4-(azaindazol-6-yl)-phenyl)-sulfonamides and their use as pharmaceuticals SANOFI (FR) 2017-08-01 US disclosed
EP-2970259-B1 N-(4-(AZAINDAZOL-6-YL)-PHENYL)-SULFONAMIDES AND THEIR USE AS PHARMACEUTICALS SANOFI SA (FR) 2016-12-21 EP disclosed
US-20160024097-A1 N-(4-(AZAINDAZOL-6-YL)-PHENYL)-SULFONAMIDES AND THEIR USE AS PHARMACEUTICALS SANOFI (FR) 2016-01-28 US disclosed
WO-2014140065-A1 N-(4-(AZAINDAZOL-6-YL)-PHENYL)-SULFONAMIDES AND THEIR USE AS PHARMACEUTICALS SANOFI (FR) 2014-09-18 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-20160024097-A1 N-(4-(AZAINDAZOL-6-YL)-PHENYL)-SULFONAMIDES AND THEIR USE AS PHARMACEUTICALS SGK1, SGK3, SGK2 HRH3 2327/4885NPC1 3076/4885RAB9A 4169/4885

“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.