SCHEMBL9288286

SCHEMBL9288286

Cc1cc2c(cc1Br)C1(CC1)CNCC2

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 9/20 0.36
HTR2C P28335 9/20 0.36
HTR2B P41595 8/20 0.35
PNMT P11086 1/20 0.33
ASIC3 Q9UHC3 1/20 0.33
ADRA2A P08913 1/20 0.32
BCHE P06276 1/20 0.32
CES1 P23141 1/20 0.32
BACE1 P56817 1/20 0.30

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
SCHEMBL1105041 0.81 HTR2C (0.60) HTR2AHTR2CHTR2B
SCHEMBL18577020 0.69 PNMT (0.52) HTR2AHTR2CHTR2BPNMTASIC3
SCHEMBL30098006 0.69 PNMT (0.52) HTR2AHTR2CHTR2BPNMTASIC3
SCHEMBL13673173 0.69 HTR2A (0.42) HTR2AHTR2CHTR2BPNMT
Hydrochloric Acid SCHEMBL7638137 0.68 PNMT (0.50) HTR2AHTR2CHTR2BPNMTASIC3
SCHEMBL29051809 0.68 DRD2 (0.49) HTR2AHTR2CHTR2B
SCHEMBL30468465 0.68 ADRA2A (0.49) HTR2AHTR2CHTR2BADRA2A
SCHEMBL6666115 0.67 RXRA (0.48) BCHECES1BACE1
SCHEMBL18537161 0.65 SIGMAR1 (0.43) HTR2AHTR2CADRA2A
SCHEMBL23813190 0.65 CRBN (0.36)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160250223-A1 5HT2C RECEPTOR MODULATORS ARENA PHARMACEUTICALS, INC. 2016-09-01 US disclosed
US-20160024014-A1 5HT2C RECEPTOR MODULATORS ARENA PHARMACEUTICALS, INC. 2016-01-28 US disclosed
US-8993750-B2 5HT2C receptor modulators ARENA PHARMACEUTICALS, INC. (US) 2015-03-31 US disclosed
US-20150087634-A1 5HT2C RECEPTOR MODULATOR COMPOSITIONS ARENA PHARMACEUTICALS, INC. 2015-03-26 US disclosed
US-20150045552-A1 5HT2C RECEPTOR MODULATORS ARENA PHARMACEUTICALS, INC. 2015-02-12 US disclosed
US-8846906-B2 5HT2C receptor modulators ARENA PHARMACEUTICALS, INC. (US) 2014-09-30 US disclosed
US-8575149-B2 5HT2C receptor modulators ARENA PHARMACEUTICALS, INC. (US) 2013-11-05 US disclosed
US-8546378-B2 5HT2C receptor modulator compositions and methods of use ARENA PHARMACEUTICALS, INC. (US) 2013-10-01 US disclosed
US-8546379-B2 5HT2C receptor modulators ARENA PHARMACEUTICALS, INC. (US) 2013-10-01 US disclosed
US-20130217676-A1 5HT2C RECEPTOR MODULATORS ARENA PHARMACEUTICALS, INC. 2013-08-22 US disclosed
US-20130217677-A1 5HT2C RECEPTOR MODULATOR COMPOSITIONS AND METHODS OF USE ARENA PHARMACEUTICALS, INC. (US) 2013-08-22 US disclosed
US-20130012495-A1 5HT2C RECEPTOR MODULATORS ARENA PHARMACEUTICALS, INC. 2013-01-10 US disclosed
US-20130012498-A1 5HT2C RECEPTOR MODULATORS ARENA PHARMACEUTICALS, INC. 2013-01-10 US disclosed
US-20120252786-A1 5HT2C RECEPTOR MODULATOR COMPOSITIONS AND METHODS OF USE ARENA PHARMACEUTICALS, INC. 2012-10-04 US disclosed
US-20120252788-A1 5HT2C RECEPTOR MODULATORS ARENA PHARMACEUTICALS, INC. 2012-10-04 US disclosed
US-8273734-B1 5HT2C receptor modulators ARENA PHARMACEUTICALS, INC. (US) 2012-09-25 US disclosed
US-8207158-B2 5HT2c receptor modulators ARENA PHARMACEUTICALS, INC. (US) 2012-06-26 US disclosed
US-20120135982-A1 5HT2c RECEPTOR MODULATORS ARENA PHARMACEUTICALS, INC. 2012-05-31 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 (11 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-20120252786-A1 5HT2C RECEPTOR MODULATOR COMPOSITIONS AND METHODS OF USE HTR2C, HTR5A, HTR2A HTR2A 3/4885HTR2C 1/4885HTR2B 11/4885
US-20130217676-A1 5HT2C RECEPTOR MODULATORS HTR2C, HTR2A, HTR1A HTR2A 2/4885HTR2C 1/4885HTR2B 7/4885
US-20130012495-A1 5HT2C RECEPTOR MODULATORS HTR2C, HTR2A, HTR1A HTR2A 2/4885HTR2C 1/4885HTR2B 7/4885
US-20130217677-A1 5HT2C RECEPTOR MODULATOR COMPOSITIONS AND METHODS OF USE HTR2C, HTR5A, HTR2A HTR2A 3/4885HTR2C 1/4885HTR2B 11/4885
US-20150087634-A1 5HT2C RECEPTOR MODULATOR COMPOSITIONS HTR2C, HTR2A, HTR5A HTR2A 2/4885HTR2C 1/4885HTR2B 10/4885
US-20120252788-A1 5HT2C RECEPTOR MODULATORS HTR2C, HTR2A, HTR1A HTR2A 2/4885HTR2C 1/4885HTR2B 7/4885
US-20160024014-A1 5HT2C RECEPTOR MODULATORS HTR2C, HTR2A, HTR1A HTR2A 2/4885HTR2C 1/4885HTR2B 7/4885
US-20120135982-A1 5HT2c RECEPTOR MODULATORS HTR2C, HTR2A, HTR1A HTR2A 2/4885HTR2C 1/4885HTR2B 7/4885
US-20150045552-A1 5HT2C RECEPTOR MODULATORS HTR2C, HTR2A, HTR1A HTR2A 2/4885HTR2C 1/4885HTR2B 7/4885
US-20130012498-A1 5HT2C RECEPTOR MODULATORS HTR2C, HTR2A, HTR1A HTR2A 2/4885HTR2C 1/4885HTR2B 7/4885
US-20160250223-A1 5HT2C RECEPTOR MODULATORS HTR2C, HTR2A, HTR1A HTR2A 2/4885HTR2C 1/4885HTR2B 7/4885

“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.