SCHEMBL627175

SCHEMBL627175

N#CCC1CCCc2ccccc21

nearest known ligand 0.51

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.46
TBXAS1 P24557 1/20 0.46
IDO1 P14902 2/20 0.45
SIGMAR1 Q99720 3/20 0.43

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
SCHEMBL31028082 1.00 CYP19A1 (0.46) CYP19A1TBXAS1IDO1SIGMAR1
SCHEMBL11729706 0.95 HTR6 (0.43) CYP19A1TBXAS1IDO1SIGMAR1
SCHEMBL627090 0.89 HTR6 (0.50) IDO1
SCHEMBL2321934 0.83 CYP19A1 (0.46) CYP19A1TBXAS1IDO1SIGMAR1
SCHEMBL16034237 0.80 CYP19A1 (0.49) CYP19A1TBXAS1IDO1SIGMAR1
SCHEMBL7898127 0.80 IDO1 (0.52) CYP19A1TBXAS1IDO1SIGMAR1
SCHEMBL16061146 0.78 HTR2A (0.42)
SCHEMBL31028096 0.78 KDM4C (0.44)
SCHEMBL13592999 0.78 ACHE (0.43) SIGMAR1
SCHEMBL11732016 0.78 HTR6 (0.45)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3354649-A1 OXA SPIRO DERIVATIVE, PREPARATION METHOD THEREFOR, AND APPLICATIONS THEREOF IN MEDICINES Jiangsu Hengrui Medicine Co., Ltd. (CN) 2018-08-01 EP disclosed
US-9156788-B2 TRPV3 modulators ABBVIE INC. (US) 2015-10-13 US disclosed
EP-2603490-A1 NOVEL TRPV3 MODULATORS AbbVie Inc. (US) 2013-06-19 EP disclosed
US-20130150409-A1 NOVEL TRPV3 MODULATORS ABBVIE INC. (US) 2013-06-13 US disclosed
WO-2012019315-A1 NOVEL TRPV3 MODULATORS ABBOTT LABORATORIES (US) 2012-02-16 WO disclosed
US-4065569-A Use of 2-imidazolines as hypoglycemic agents SCHERING CORPORATION (US) 1977-12-27 US disclosed
US-3992403-A 2-Imidazolines and their use as hypoglycemic agents SCHERING CORPORATION (US) 1976-11-16 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 (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-20130150409-A1 NOVEL TRPV3 MODULATORS TRPV3, TRPV4, TRPV5 CYP19A1 3414/4885TBXAS1 564/4885IDO1 1744/4885

“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.