SCHEMBL123385

SCHEMBL123385

COc1cc(-c2c(CCC(=O)O)c(C3CCCC3)n3ncnc(N)c23)ccc1Oc1cccc(Cl)c1

nearest known ligand 0.65

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BTK Q06187 3/20 0.65
TNK2 Q07912 15/20 0.51
RIPK1 Q13546 1/20 0.38
FFAR4 Q5NUL3 1/20 0.38

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
SCHEMBL170106 0.94 BTK (0.57) BTKTNK2RIPK1
SCHEMBL123306 0.91 BTK (0.64) BTKTNK2
SCHEMBL124142 0.90 BTK (0.53) BTKTNK2RIPK1
SCHEMBL124143 0.90 BTK (0.53) BTKTNK2RIPK1
SCHEMBL122059 0.90 BTK (0.83) BTKTNK2
SCHEMBL166399 0.89 BTK (0.50) BTKTNK2FFAR4
SCHEMBL16267066 0.89 BTK (0.53) BTKTNK2
SCHEMBL175282 0.88 BTK (0.60) BTKTNK2
SCHEMBL169925 0.88 BTK (0.50) BTKTNK2RIPK1
SCHEMBL122380 0.87 BTK (0.53) BTKTNK2RIPK1

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 31 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111051449-B Polysiloxane composition 瓦克化学股份公司 2022-11-22 CN claimed
CN-111051449-A Polysiloxane composition 瓦克化学股份公司 2020-04-21 CN claimed
EP-2424368-B1 PYRROLOTRIAZINE COMPOUNDS LOCUS PHARMACEUTICALS INC (US) 2014-12-31 EP claimed
US-8765754-B2 Pyrrolotriazine compounds LOCUS PHARMACEUTICALS, INC. (US) 2014-07-01 US claimed
US-20120232054-A1 PYRROLOTRIAZINE COMPOUNDS LOCUS PHARMACEUTICALS, INC. (US) 2012-09-13 US claimed
EP-2424368-A1 PYRROLOTRIAZINE COMPOUNDS Locus Pharmaceuticals, Inc. (US) 2012-03-07 EP claimed
WO-2010126960-A1 PYRROLOTRIAZINE COMPOUNDS LOCUS PHARMACEUTICALS, INC. (US) 2010-11-04 WO claimed
EP-0636471-B1 Method for producing of a laminated glass ASAHI GLASS CO LTD (JP) 2001-03-21 EP claimed
US-5569537-A CONTAINING MIXTURE OF COUPLING AGENTS ONLY ONE OF WHICH IS CAPABLE OF PROVIDING BOND STRENGTH BETWEEN GLASS AND RESIN; DURABILITY ASAHI GLASS COMPANY LTD. (JP) 1996-10-29 US claimed
EP-0636471-A1 Laminated glass and method for its production ASAHI GLASS COMPANY LTD. (JP) 1995-02-01 EP claimed
CN-111051449-B Polysiloxane composition 瓦克化学股份公司 2022-11-22 CN disclosed
CN-111051449-A Polysiloxane composition 瓦克化学股份公司 2020-04-21 CN disclosed
US-20160074409-A1 Treatment of Skeletal-Related Disorders ROTHBAUM WAYNE (US) 2016-03-17 US disclosed
US-8987344-B2 Hardcoat composition MITSUI CHEMICALS, INC. (JP) 2015-03-24 US disclosed
EP-2424368-B1 PYRROLOTRIAZINE COMPOUNDS LOCUS PHARMACEUTICALS INC (US) 2014-12-31 EP disclosed
EP-1728830-A2 Fluorosilicone rubber composition and molded rubber article Shin-Etsu Chemical Co., Ltd. (JP) 2006-12-06 EP disclosed
EP-0636471-B1 Method for producing of a laminated glass ASAHI GLASS CO LTD (JP) 2001-03-21 EP disclosed
US-5773178-A Process for producing a patterned anisotropic polymeric film JAPAN SYNTHETIC RUBBER CO, LTD. (JP) 1998-06-30 US disclosed
US-5569537-A CONTAINING MIXTURE OF COUPLING AGENTS ONLY ONE OF WHICH IS CAPABLE OF PROVIDING BOND STRENGTH BETWEEN GLASS AND RESIN; DURABILITY ASAHI GLASS COMPANY LTD. (JP) 1996-10-29 US disclosed
EP-0636471-A1 Laminated glass and method for its production ASAHI GLASS COMPANY LTD. (JP) 1995-02-01 EP 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 (2 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-20160074409-A1 Treatment of Skeletal-Related Disorders SOST, COL2A1, CYP27B1 BTK 4374/4885TNK2 1030/4885RIPK1 4329/4885
US-20120232054-A1 PYRROLOTRIAZINE COMPOUNDS BTK, SYK, ZAP70 BTK 1/4885TNK2 511/4885RIPK1 624/4885

“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.