SCHEMBL4032026

SCHEMBL4032026

COc1cc(N)ccc1OCCN1CCC(F)(F)CC1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 5/20 0.48
KDM4E B2RXH2 1/20 0.48
GAA P10253 1/20 0.48
MAPT P10636 1/20 0.48
LTA4H P09960 1/20 0.47
MCHR1 Q99705 3/20 0.45
ADRA1A P35348 2/20 0.43
ADRA1B P35368 2/20 0.43
CACNA1F O60840 1/20 0.42
CACNA1D Q01668 1/20 0.42
CACNA1S Q13698 1/20 0.42
CACNA1C Q13936 1/20 0.42
AXL P30530 1/20 0.41
POLB P06746 1/20 0.41
HTR2A P28223 3/20 0.40
HTR2B P41595 3/20 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
SCHEMBL4027659 0.95 HTR2C (0.53) HTR2CLTA4HHTR2AHTR2B
SCHEMBL5260766 0.93 MCHR1 (0.52) HTR2CKDM4EGAAMAPTLTA4H
SCHEMBL264641 0.85 LTA4H (0.62) HTR2CKDM4EGAAMAPTLTA4H
SCHEMBL5381539 0.85 LTA4H (0.59) HTR2CKDM4EGAAMAPTLTA4H
SCHEMBL4267515 0.84 LTA4H (0.61) HTR2CKDM4EGAAMAPTLTA4H
SCHEMBL31378713 0.84 LTA4H (0.61) HTR2CKDM4EGAAMAPTLTA4H
SCHEMBL6313608 0.84 KDM4E (0.53) KDM4EGAAMAPTLTA4HMCHR1
SCHEMBL5473943 0.83 HTR2C (0.55) HTR2CKDM4EGAAMAPTLTA4H
Hydrochloric Acid SCHEMBL5474810 0.82 HTR2C (0.54) HTR2CKDM4EGAAMAPTLTA4H
SCHEMBL2085669 0.82 SYK (0.58) HTR2CKDM4EGAAMAPTMCHR1

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 2/4885KDM4E 3958/4885GAA 4737/4885

“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.