SCHEMBL3600768

SCHEMBL3600768

O=C1CCC(c2cccc(C(F)(F)F)c2)N1

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 4/20 0.51
MRGPRX4 Q96LA9 1/20 0.46
PBRM1 Q86U86 1/20 0.45
HTR2A P28223 2/20 0.45
HTR2B P41595 2/20 0.45
GUSB P08236 1/20 0.43
HTR1A P08908 1/20 0.43
ALOX5 P09917 1/20 0.42
PDE4A P27815 1/20 0.41
PDE4B Q07343 1/20 0.41
PDE4C Q08493 1/20 0.41
PDE4D Q08499 1/20 0.41
DRD2 P14416 1/20 0.41
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
MAPK1 P28482 1/20 0.40
HSD17B10 Q99714 1/20 0.40
KDM1A O60341 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
SCHEMBL30640419 1.00 HTR2C (0.51) HTR2CMRGPRX4PBRM1HTR2AHTR2B
SCHEMBL3600762 1.00 HTR2C (0.51) HTR2CMRGPRX4PBRM1HTR2AHTR2B
SCHEMBL11634535 0.85 HTR2C (0.49) HTR2CMRGPRX4PBRM1HTR2AHTR2B
SCHEMBL22201144 0.81 PARP1 (0.48) HTR2CPDE4APDE4BPDE4CPDE4D
SCHEMBL22190351 0.81 PARP1 (0.48) HTR2CPDE4APDE4BPDE4CPDE4D
SCHEMBL432587 0.80 KDM4E (0.44) ALOX5PDE4APDE4BPDE4CPDE4D
SCHEMBL10242828 0.79 HTR2C (0.48) HTR2CMRGPRX4PBRM1HTR2AHTR2B
SCHEMBL18150715 0.78 HTR1A (0.46) HTR2CMRGPRX4PBRM1HTR2AHTR2B
SCHEMBL29746117 0.78 HTR2C (0.48) HTR2CPBRM1HTR2AHTR2BHTR1A
SCHEMBL18159802 0.78 HTR1A (0.46) HTR2CMRGPRX4PBRM1HTR2AHTR2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250326766-A1 RIPK1 INHIBITORS AND METHODS OF USE MERCK SHARP & DOHME LLC (US) 2025-10-23 US disclosed
EP-4526300-A1 RIPK1 INHIBITORS AND METHODS OF USE Merck Sharp & Dohme LLC (US) 2025-03-26 EP disclosed
US-20240025912-A1 RIPK1 INHIBITORS AND METHODS OF USE MERCK SHARP & DOHME LLC (US) 2024-01-25 US disclosed
US-20240025912-A1 RIPK1 INHIBITORS AND METHODS OF USE MERCK SHARP & DOHME LLC (US) 2024-01-25 US disclosed
US-20240025912-A1 RIPK1 INHIBITORS AND METHODS OF USE MERCK SHARP & DOHME LLC (US) 2024-01-25 US disclosed
WO-2023225041-A1 RIPK1 INHIBITORS AND METHODS OF USE MERCK SHARP & DOHME LLC (US) 2023-11-23 WO disclosed
US-20130210769-A1 COMPOUNDS AND COMPOSITIONS AS INHIBITORS OF CANNABINOID RECEPTOR 1 ACTIVITY IRM LLC (BM) 2013-08-15 US disclosed
US-8431607-B2 Compounds and compositions as inhibitors of cannabinoid receptor 1 activity IRM LLC, A DELAWARE LIMITED LIABILITY COMPANY (BM) 2013-04-30 US disclosed
US-20100234365-A1 COMPOUNDS AND COMPOSITIONS AS INHIBITORS OF CANNABINOID RECEPTOR 1 ACTIVITY IRM LLC (BM) 2010-09-16 US disclosed
CN-101600689-A Compounds and compositions as inhibitors of cannabinoid receptor 1 activity IRM LLC (VG) 2009-12-09 CN disclosed
EP-2121598-A2 COMPOUNDS AND COMPOSITIONS AS INHIBITORS OF CANNABINOID RECEPTOR 1 ACTIVITY IRM LLC (BM) 2009-11-25 EP disclosed
WO-2008076754-A2 COMPOUNDS AND COMPOSITIONS AS INHIBITORS OF CANNABINOID RECEPTOR 1 ACTIVITY IRM LLC (BM) 2008-06-26 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 (4 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-20240025912-A1 RIPK1 INHIBITORS AND METHODS OF USE RIPK1, RIPK2, RIPK3 HTR2C 4869/4885MRGPRX4 2880/4885PBRM1 2182/4885
US-20250326766-A1 RIPK1 INHIBITORS AND METHODS OF USE RIPK1, RIPK2, RIPK3 HTR2C 4870/4885MRGPRX4 2761/4885PBRM1 1872/4885
US-20130210769-A1 COMPOUNDS AND COMPOSITIONS AS INHIBITORS OF CANNABINOID RECEPTOR 1 ACTIVITY CNR1, CNR2, FAAH HTR2C 189/4885MRGPRX4 427/4885PBRM1 1288/4885
US-20100234365-A1 COMPOUNDS AND COMPOSITIONS AS INHIBITORS OF CANNABINOID RECEPTOR 1 ACTIVITY CNR1, CNR2, FAAH HTR2C 189/4885MRGPRX4 427/4885PBRM1 1288/4885

“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.