SCHEMBL300150

SCHEMBL300150

O=C1Cc2ccccc2C(C2CCCCC2)C1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 7/20 0.50
HTR2C P28335 6/20 0.50
HTR2B P41595 6/20 0.50
HRH3 Q9Y5N1 5/20 0.50
CYP1A2 P05177 1/20 0.41
PRCP P42785 1/20 0.41
SIGMAR1 Q99720 3/20 0.40
ANPEP P15144 2/20 0.40
ACHE P22303 1/20 0.39
TP53 P04637 1/20 0.38
RECQL P46063 1/20 0.38
MAPT P10636 1/20 0.36
HPGD P15428 1/20 0.36
CYP2A6 P11509 1/20 0.36

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
SCHEMBL6169947 0.76 SIGMAR1 (0.47) SIGMAR1
SCHEMBL7706950 0.76 SIGMAR1 (0.47) SIGMAR1
SCHEMBL22879323 0.75 HTR2A (0.37) HTR2AHTR2CHTR2BHRH3CYP1A2
SCHEMBL8584826 0.73 HTR2A (0.47) HTR2AHTR2CHTR2BHRH3ANPEP
SCHEMBL12162771 0.73 ANPEP (0.40) HTR2AHTR2CHTR2BHRH3ANPEP
SCHEMBL11460515 0.73 SIGMAR1 (0.56) HTR2AHTR2CHTR2BHRH3PRCP
SCHEMBL6587468 0.72 PARP1 (0.46) HTR2AHTR2CHTR2BHRH3ACHE
SCHEMBL7993604 0.72 SIGMAR1 (0.41) HTR2AHTR2CHTR2BHRH3SIGMAR1
SCHEMBL7709439 0.72 SIGMAR1 (0.47) SIGMAR1
SCHEMBL8051810 0.72 SIGMAR1 (0.47) SIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10017458-B2 Therapeutic tetrahydronaphthalene compounds UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INCORPORATED (US) 2018-07-10 US disclosed
US-20150315127-A1 THERAPEUTIC COMPOUNDS UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. 2015-11-05 US disclosed
US-9024071-B2 Therapeutic compounds UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2015-05-05 US disclosed
US-9024071-B2 Therapeutic compounds UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2015-05-05 US disclosed
US-9024071-B2 Therapeutic compounds UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2015-05-05 US disclosed
US-20120149693-A1 THERAPEUTIC COMPOUNDS UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2012-06-14 US disclosed
US-20120149693-A1 THERAPEUTIC COMPOUNDS UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2012-06-14 US disclosed
US-20120149693-A1 THERAPEUTIC COMPOUNDS UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2012-06-14 US disclosed
EP-2427183-A2 THERAPEUTIC COMPOUNDS University of Florida Research Foundation, Inc. (US) 2012-03-14 EP disclosed
WO-2010129048-A2 THERAPEUTIC COMPOUNDS UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2010-11-11 WO disclosed
WO-2010129048-A2 THERAPEUTIC COMPOUNDS UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2010-11-11 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 (3 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-20120149693-A1 THERAPEUTIC COMPOUNDS HTR2C, GRK2, GRK3 HTR2A 7/4885HTR2C 1/4885HTR2B 21/4885
US-10017458-B2 Therapeutic tetrahydronaphthalene compounds HTR2C, HTR2A, HTR3C HTR2A 2/4885HTR2C 1/4885HTR2B 12/4885
US-20150315127-A1 THERAPEUTIC COMPOUNDS HTR2C, GRK2, GRK3 HTR2A 7/4885HTR2C 1/4885HTR2B 21/4885

“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.