SCHEMBL2668604

SCHEMBL2668604

C[C@H]1CC[C@H](OCC2CC2)CC1

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CTSL P07711 1/20 0.35
CTSB P07858 1/20 0.35
CTSK P43235 1/20 0.35
JAK2 O60674 1/20 0.35
JAK1 P23458 1/20 0.35
HCRTR2 O43614 3/20 0.35
EPHX2 P34913 1/20 0.30
HPGD P15428 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
SCHEMBL21537525 1.00 CTSL (0.35) CTSLCTSBCTSKJAK2JAK1
SCHEMBL8263000 1.00 CTSL (0.35) CTSLCTSBCTSKJAK2JAK1
SCHEMBL20664323 0.93 HCRTR2 (0.33) CTSLCTSBCTSKJAK2JAK1
SCHEMBL11957389 0.93 HCRTR2 (0.33) CTSLCTSBCTSKJAK2JAK1
SCHEMBL803142 0.93 HCRTR2 (0.33) CTSLCTSBCTSKJAK2JAK1
SCHEMBL14701093 0.93 HCRTR2 (0.33) CTSLCTSBCTSKJAK2JAK1
SCHEMBL20664231 0.91 HCRTR2 (0.32) CTSLCTSBCTSKJAK2JAK1
SCHEMBL20664361 0.88 HCRTR2 (0.31) CTSLCTSBCTSKJAK2JAK1
SCHEMBL11266221 0.88 HCRTR2 (0.31) CTSLCTSBCTSKJAK2JAK1
SCHEMBL11266225 0.88 HCRTR2 (0.31) CTSLCTSBCTSKJAK2JAK1

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-20160355511-A1 NOVEL 1-SUBSTITUTED INDAZOLE DERIVATIVE DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2016-12-08 US disclosed
US-20160355511-A1 NOVEL 1-SUBSTITUTED INDAZOLE DERIVATIVE DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2016-12-08 US disclosed
US-9309221-B2 1-substituted indazole derivative SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2016-04-12 US disclosed
US-9309221-B2 1-substituted indazole derivative SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2016-04-12 US disclosed
US-9051295-B2 1-substituted indazole derivative SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2015-06-09 US disclosed
US-9051295-B2 1-substituted indazole derivative SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2015-06-09 US disclosed
EP-2837623-A1 NOVEL 1-SUBSTITUTED INDAZOLE DERIVATIVE Sumitomo Dainippon Pharma Co., Ltd. (JP) 2015-02-18 EP disclosed
US-20150031681-A1 NOVEL 1-SUBSTITUTED INDAZOLE DERIVATIVE Sumitomo Pharma Co., Ltd. (JP) 2015-01-29 US disclosed
US-20150031681-A1 NOVEL 1-SUBSTITUTED INDAZOLE DERIVATIVE Sumitomo Pharma Co., Ltd. (JP) 2015-01-29 US disclosed
US-8765786-B2 1-substituted indazole derivative DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2014-07-01 US disclosed
US-8765786-B2 1-substituted indazole derivative DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2014-07-01 US disclosed
US-20140121244-A1 NOVEL 1-SUBSTITUTED INDAZOLE DERIVATIVE Sumitomo Pharma Co., Ltd. (JP) 2014-05-01 US disclosed
US-20140121244-A1 NOVEL 1-SUBSTITUTED INDAZOLE DERIVATIVE Sumitomo Pharma Co., Ltd. (JP) 2014-05-01 US disclosed
US-20140121243-A1 NOVEL 1-SUBSTITUTED INDAZOLE DERIVATIVE Sumitomo Pharma Co., Ltd. (JP) 2014-05-01 US disclosed
US-20140121243-A1 NOVEL 1-SUBSTITUTED INDAZOLE DERIVATIVE Sumitomo Pharma Co., Ltd. (JP) 2014-05-01 US disclosed
WO-2013154109-A1 NOVEL 1-SUBSTITUTED INDAZOLE DERIVATIVE 大日本住友製薬株式会社 (JP) 2013-10-17 WO disclosed
US-20080306069-A1 Pyrazole Derivatives for the Inhibition of CDK'S and GSK'S ASTEX THERAPEUTICS LIMITED (UK) 2008-12-11 US disclosed
WO-2007006814-A1 UREA GLUCOKINASE ACTIVATORS NOVO NORDISK A/S (DK) 2007-01-18 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 (5 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-20140121244-A1 NOVEL 1-SUBSTITUTED INDAZOLE DERIVATIVE CHRNA3, CHRNB3, CHRNA7 CTSL 4351/4885CTSB 3336/4885CTSK 3850/4885
US-20080306069-A1 Pyrazole Derivatives for the Inhibition of CDK'S and GSK'S GSK3A, CDK11A, CDK1 CTSL 3807/4885CTSB 4266/4885CTSK 3631/4885
US-20160355511-A1 NOVEL 1-SUBSTITUTED INDAZOLE DERIVATIVE CHRNA3, CHRNB3, CHRNA7 CTSL 4351/4885CTSB 3336/4885CTSK 3850/4885
US-20140121243-A1 NOVEL 1-SUBSTITUTED INDAZOLE DERIVATIVE CHRNA3, CHRNB3, CHRNA7 CTSL 4351/4885CTSB 3336/4885CTSK 3850/4885
US-20150031681-A1 NOVEL 1-SUBSTITUTED INDAZOLE DERIVATIVE CHRNA3, CHRNB3, CHRNA7 CTSL 4351/4885CTSB 3336/4885CTSK 3850/4885

“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.