SCHEMBL25344328

SCHEMBL25344328

Clc1ccc(C[C]2CCNCC2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 7/20 0.53
HTR2B P41595 6/20 0.53
HTR2A P28223 3/20 0.44
CETP P11597 1/20 0.42
SIGMAR1 Q99720 2/20 0.41
MLNR O43193 1/20 0.40
HTR3A P46098 2/20 0.39
HTR3E A5X5Y0 1/20 0.39
HTR3B O95264 1/20 0.39
ADRB1 P08588 1/20 0.39
HTR3D Q70Z44 1/20 0.39
HTR3C Q8WXA8 1/20 0.39
HTR7 P34969 2/20 0.39
HTR6 P50406 2/20 0.39
IDO1 P14902 1/20 0.38
HTR1D P28221 1/20 0.38
HTR1E P28566 1/20 0.38
PNMT P11086 1/20 0.37
DRD2 P14416 1/20 0.37
DAO P14920 2/20 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
SCHEMBL25343658 0.88 HTR2C (0.46) HTR2CHTR2BHTR2ACETPSIGMAR1
SCHEMBL9346811 0.84 IDO1 (0.46) HTR2CHTR2BHTR2ASIGMAR1IDO1
SCHEMBL25343311 0.82 KDM4E (0.45) HTR2CHTR2BSIGMAR1IDO1CYP3A4
SCHEMBL1691780 0.79 SIGMAR1 (0.50) SIGMAR1ADRB1IDO1PNMTCYP3A4
SCHEMBL6604926 0.78 HTR2C (0.50) HTR2CHTR2BHTR2ASIGMAR1HTR3A
SCHEMBL11634417 0.73 SIGMAR1 (0.53) HTR2CHTR2BHTR2ACETPSIGMAR1
Hydrochloric Acid SCHEMBL7400956 0.72 HTR2C (0.54) HTR2CHTR2BHTR2ACETPSIGMAR1
SCHEMBL1106684 0.71 IDO1 (0.58) HTR2BHTR2AIDO1DAOCYP3A4
SCHEMBL4786748 0.71 HTR2C (0.49) HTR2CHTR2BSIGMAR1HTR3AHTR3E
SCHEMBL1574487 0.71 HTR2C (0.42) HTR2CHTR2BHTR2ACETPSIGMAR1

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
US-20240083839-A1 COMPOSITIONS AND METHODS FOR TREATING NEURODEGENERATIVE DISEASES AND DISORDERS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2024-03-14 US disclosed
EP-4225730-A1 COMPOSITIONS AND METHODS FOR TREATING NEURODEGENERATIVE DISEASES AND DISORDERS The Regents of the University of California (US) 2023-08-16 EP 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-20240083839-A1 COMPOSITIONS AND METHODS FOR TREATING NEURODEGENERATIVE DISEASES AND DISORDERS PRMT8, SIRT1, PRMT3 HTR2C 4208/4885HTR2B 4303/4885HTR2A 2772/4885

“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.