SCHEMBL898911

SCHEMBL898911

[SnH]CC(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 6/20 0.46
KCNN4 O15554 4/20 0.41
TSHR P16473 2/20 0.41
ALDH1A1 P00352 1/20 0.41
TAAR1 Q96RJ0 1/20 0.39
CYP11B1 P15538 1/20 0.38
CYP11B2 P19099 1/20 0.38
CYP1A2 P05177 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
MAPK1 P28482 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL10932723 0.78 KIF11 (0.54) KIF11KCNN4TSHRALDH1A1CYP11B1
SCHEMBL28873040 0.75 KIF11 (0.50) KIF11KCNN4TSHRALDH1A1TAAR1
SCHEMBL1149158 0.75 KIF11 (0.64) KIF11KCNN4TSHRALDH1A1TAAR1
SCHEMBL1030653 0.74 KIF11 (0.61) KIF11CYP11B1CYP11B2CYP2C9CYP2C19
SCHEMBL17151091 0.71 TSHR (0.48) KIF11KCNN4TSHRALDH1A1TAAR1
SCHEMBL7094449 0.71 KIF11 (0.46) KIF11KCNN4TSHRALDH1A1TAAR1
SCHEMBL9319485 0.71 KIF11 (0.46) KIF11KCNN4TSHRALDH1A1TAAR1
SCHEMBL913404 0.71 KIF11 (0.46) KIF11KCNN4TSHRALDH1A1TAAR1
SCHEMBL766983 0.71 KIF11 (0.46) KIF11KCNN4TSHRALDH1A1TAAR1
SCHEMBL1971090 0.71 KCNN4 (0.48) KIF11KCNN4TSHRALDH1A1TAAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116655457-A Method for preparing resorcinol 万华化学集团股份有限公司 2023-08-29 CN claimed
CN-116655457-A Method for preparing resorcinol 万华化学集团股份有限公司 2023-08-29 CN disclosed
US-20150080581-A1 MULTICOORDINATED METAL COMPLEXES FOR USE IN METATHESIS REACTIONS RIMTEC CORPORATION (JP) 2015-03-19 US disclosed
US-8927670-B2 Multicoordinated metal complexes for use in metathesis reactions RIMTEC CORPORATION (JP) 2015-01-06 US disclosed
EP-2397475-B1 4, 4' disubstituted 4H-cyclopentadithiophene and new methods for synthesising the same IMEC (BE) 2014-11-12 EP disclosed
US-8765882-B2 Polythiophene based active layer for solar cells IMEC (BE) 2014-07-01 US disclosed
US-8698086-B2 High effective atomic number polymer scintillators for gamma ray spectroscopy LAWRENCE LIVERMORE NATIONAL SECURITY, LLC (US) 2014-04-15 US disclosed
US-8450604-B2 Polymerisable compounds for making opto-electronic devices IMEC (BE) 2013-05-28 US disclosed
US-8329923-B2 4, 4′ disubstituted 4H-cyclopentadithiophene and new methods for synthesizing the same IMEC (BE) 2012-12-11 US disclosed
US-20120279569-A1 POLYTHIOPHENE BASED ACTIVE LAYER FOR SOLAR CELLS UNIVERSITEIT HASSELT (BE) 2012-11-08 US disclosed
US-20080293905-A9 MULTICOORDINATED METAL COMPLEXES FOR USE IN METATHESIS REACTIONS RIMTEC CORPORATION (JP) 2008-11-27 US disclosed
WO-2007022945-A2 MULTICOORDINATED METAL COMPLEXES FOR USE IN METATHESIS REACTIONS VIACATT N.V. (BE) 2007-03-01 WO disclosed
EP-1757613-A1 Multicoordinated metal complexes for use in metathesis reactions Viacatt N.V. (BE) 2007-02-28 EP disclosed
US-20070043188-A1 MULTICOORDINATED METAL COMPLEXES FOR USE IN METATHESIS REACTIONS TELENE S.A.S. (FR) 2007-02-22 US disclosed
US-6624116-B1 Co-feeding a volatile Group 8B metal compound and/or a volatile promoter compound with the paraffinic hydrocarbon and oxygen feedstream into the oxidation reactor under ignition or autothermal process conditions DOW GLOBAL TECHNOLOGIES INC. 2003-09-23 US disclosed
EP-1114013-B1 ON-LINE SYNTHESIS AND REGENERATION OF A CATALYST USED IN AUTOTHERMAL OXIDATION DOW CHEMICAL CO (US) 2002-11-27 EP disclosed
EP-1114013-A1 ON-LINE SYNTHESIS AND REGENERATION OF A CATALYST USED IN AUTOTHERMAL OXIDATION THE DOW CHEMICAL COMPANY (US) 2001-07-11 EP disclosed
US-6166283-A On-line synthesis and regenerating of a catalyst used in autothermal oxidation THE DOW CHEMICAL COMPANY (US) 2000-12-26 US disclosed
WO-2000014037-A1 ON-LINE SYNTHESIS AND REGENERATION OF A CATALYST USED IN AUTOTHERMAL OXIDATION THE DOW CHEMICAL COMPANY (US) 2000-03-16 WO disclosed
US-4547320-A ANTITUMOR AGENTS NEDERLANDSE CENTRALE ORGANISATIE VOOR TOEGEPAST-NATUURWETENSCHAPPELIJK ONDERZOEK (NL) 1985-10-15 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 (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-20150080581-A1 MULTICOORDINATED METAL COMPLEXES FOR USE IN METATHESIS REACTIONS APEX1, SOD1, AP1M1 KIF11 2188/4885KCNN4 1023/4885TSHR 4417/4885
US-20120279569-A1 POLYTHIOPHENE BASED ACTIVE LAYER FOR SOLAR CELLS SCO2, CLTB, CLTC KIF11 3448/4885KCNN4 124/4885TSHR 4501/4885

“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.