SCHEMBL9921265

SCHEMBL9921265

COCCCN1CC[C@@H](O)C1

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 13/20 0.49
HRH2 P25021 4/20 0.49
HRH1 P35367 4/20 0.49
HTR1A P08908 1/20 0.47
PDCD1 Q15116 1/20 0.41
CD274 Q9NZQ7 1/20 0.41
LTA4H P09960 1/20 0.41
ACHE P22303 1/20 0.38
SLC6A4 P31645 1/20 0.37

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
SCHEMBL13552419 1.00 HRH3 (0.49) HRH3HRH2HRH1HTR1APDCD1
SCHEMBL12717290 1.00 HRH3 (0.49) HRH3HRH2HRH1HTR1APDCD1
SCHEMBL12717292 0.89 HTR1A (0.58) HRH3HRH2HRH1HTR1A
SCHEMBL20698407 0.89 HTR1A (0.58) HRH3HRH2HRH1HTR1A
SCHEMBL14419811 0.89 HTR1A (0.58) HRH3HRH2HRH1HTR1A
SCHEMBL9921273 0.89 LTA4H (0.47) HRH3HRH2HRH1HTR1APDCD1
SCHEMBL16418018 0.89 LTA4H (0.47) HRH3HRH2HRH1HTR1APDCD1
SCHEMBL12717293 0.89 HRH3 (0.47) HRH3HRH2HRH1ACHESLC6A4
SCHEMBL5949496 0.89 LTA4H (0.47) HRH3HRH2HRH1HTR1APDCD1
SCHEMBL20698402 0.84 GBA1 (0.44) HRH3HRH2HRH1HTR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4105203-A1 SPIRO-CONDENSED INDOLE COMPOUNDS AS EHMT2 INHIBITORS Epizyme Inc (US) 2022-12-21 EP disclosed
EP-3664793-B1 MACROCYCLIC IMMUNOMODULATORS CHEMOCENTRYX INC (US) 2022-06-29 EP disclosed
EP-3658522-B1 IMMUNOMODULATOR COMPOUNDS CHEMOCENTRYX INC (US) 2021-12-22 EP disclosed
US-11059834-B2 Macrocyclic immunomodulators CHEMOCENTRYX, INC. (US) 2021-07-13 US disclosed
WO-2020047035-A1 METHODS OF TREATING CANCER WITH SMALL MOLECULE PD-L1 INHIBITORS CHEMOCENTRYX, INC. (US) 2020-03-05 WO disclosed
US-20200055869-A1 MACROCYCLIC IMMUNOMODULATORS CHEMOCENTRYX, INC. 2020-02-20 US disclosed
WO-2019032547-A1 MACROCYCLIC IMMUNOMODULATORS CHEMOCENTRYX, INC. (US) 2019-02-14 WO disclosed
WO-2019023575-A1 IMMUNOMODULATOR COMPOUNDS CHEMOCENTRYX, INC. (US) 2019-01-31 WO disclosed
WO-2018064557-A1 SUBSTITUTED FUSED BI- OR TRI- HETEROCYCLIC COMPOUNDS AS EHMT2 INHIBITORS Epizyme, Inc. (US) 2018-04-05 WO disclosed
US-9149463-B2 Methods and compositions of treating a Flaviviridae family viral infection THE BOARD OF TRUSTEES OF THE LELAND STANDFORD JUNIOR UNIVERSITY (US) 2015-10-06 US disclosed
US-20150152064-A1 METHODS AND COMPOSITIONS OF TREATING A FLAVIVIRIDAE FAMILY VIRAL INFECTION THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY 2015-06-04 US disclosed
US-8940730-B2 Methods and compositions of treating a Flaviviridae family viral infection THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2015-01-27 US disclosed
US-20120148534-A1 METHODS AND COMPOSITIONS OF TREATING A FLAVIVIRIDAE FAMILY VIRAL INFECTION NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2012-06-14 US disclosed
US-20100015093-A1 Methods and compositions of treating a flaviviridae family viral infection THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY 2010-01-21 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 (5 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-11059834-B2 Macrocyclic immunomodulators IL2, IL2RA, C3AR1 HRH3 162/4885HRH2 158/4885HRH1 234/4885
US-20120148534-A1 METHODS AND COMPOSITIONS OF TREATING A FLAVIVIRIDAE FAMILY VIRAL INFECTION EIF2AK2, NSUN3, NSUN2 HRH3 4193/4885HRH2 4404/4885HRH1 4601/4885
US-20100015093-A1 Methods and compositions of treating a flaviviridae family viral infection EIF2AK2, NSUN3, NSUN2 HRH3 4193/4885HRH2 4404/4885HRH1 4601/4885
US-20150152064-A1 METHODS AND COMPOSITIONS OF TREATING A FLAVIVIRIDAE FAMILY VIRAL INFECTION EIF2AK2, NSUN3, NSUN2 HRH3 4193/4885HRH2 4404/4885HRH1 4601/4885
US-20200055869-A1 MACROCYCLIC IMMUNOMODULATORS IL2, IL2RA, C3AR1 HRH3 162/4885HRH2 158/4885HRH1 234/4885

“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.