SCHEMBL4022248

SCHEMBL4022248

COc1ccc(C(N)=O)cc1OCCN1CCC(C)CC1

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 16/20 0.54
HTR2B P41595 9/20 0.54
KDM4E B2RXH2 2/20 0.53
ALDH1A1 P00352 2/20 0.53
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
HTR2A P28223 9/20 0.52
SMN1; SMN2 Q16637 1/20 0.52

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
SCHEMBL6200574 0.88 MEN1 (0.55) HTR2CHTR2BMEN1KMT2AHTR2A
SCHEMBL4023275 0.86 MEN1 (0.57) HTR2CHTR2BMEN1KMT2AHTR2A
SCHEMBL3841383 0.84 MAPK1 (0.60) KDM4EMEN1KMT2ASMN1; SMN2
SCHEMBL4267510 0.83 MCHR1 (0.60) KDM4EMEN1KMT2ASMN1; SMN2
SCHEMBL4022252 0.83 HTR2C (0.58) HTR2CHTR2BHTR2A
SCHEMBL4027655 0.82 HTR2C (0.50) HTR2CHTR2BKDM4EALDH1A1MEN1
Hydrochloric Acid SCHEMBL5237943 0.81 HTR2C (0.57) HTR2CHTR2BHTR2A
SCHEMBL5779141 0.81 SIGMAR1 (0.63) KDM4EALDH1A1KMT2A
SCHEMBL4267324 0.81 CYP2D6 (0.60) HTR2CHTR2BKDM4EALDH1A1SMN1; SMN2
Hydrochloric Acid SCHEMBL3859178 0.80 SIGMAR1 (0.65) KDM4EALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1497265-B1 COMPOUNDS HAVING AFFINITY AT 5HT2C RECEPTOR AND USE THEREOF IN THERAPY GLAXO GROUP LTD (GB) 2009-02-18 EP disclosed
US-20050203079-A1 Compounds having affinity at 5ht2C receptor and use thereof in therapy GLAXO GROUP LIMITED 2005-09-15 US disclosed
EP-1497265-A1 COMPOUNDS HAVING AFFINITY AT 5HT2C RECEPTOR AND USE THEREOF IN THERAPY GLAXO GROUP LIMITED (GB) 2005-01-19 EP disclosed
WO-2003089409-A1 COMPOUNDS HAVING AFFINITY AT 5HT2C RECEPTOR AND USE THEREOF IN THERAPY GLAXO GROUP LIMITED (GB) 2003-10-30 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-20050203079-A1 Compounds having affinity at 5ht2C receptor and use thereof in therapy HTR7, HTR2C, HTR3C HTR2C 2/4885HTR2B 25/4885KDM4E 3958/4885

“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.