SCHEMBL1610965

SCHEMBL1610965

C=[C]c1ccc(C)cc1C

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 4/20 0.42
TP53 P04637 2/20 0.42
CYP1A2 P05177 2/20 0.38
CYP2A6 P11509 2/20 0.38
ALDH1A1 P00352 1/20 0.37
RAPGEF4 Q8WZA2 3/20 0.35
ACHE P22303 2/20 0.33
CYP3A4 P08684 2/20 0.33
THRB P10828 1/20 0.33
ALOX15 P16050 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
TRPA1 O75762 1/20 0.33
PYCR1 P32322 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
ADRA2A P08913 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32

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
SCHEMBL1611249 0.80 TDP1 (0.42) TDP1TP53CYP1A2CYP2A6ALDH1A1
SCHEMBL3686045 0.79 TDP1 (0.46) TDP1TP53CYP1A2CYP2A6ALDH1A1
SCHEMBL19604062 0.78 TDP1 (0.41) TDP1TP53CYP1A2CYP2A6ALDH1A1
SCHEMBL277588 0.75 TSHR (0.52) TDP1TP53CYP1A2CYP2A6ALDH1A1
SCHEMBL1611111 0.75 TDP1 (0.42) TDP1TP53CYP1A2CYP2A6ALDH1A1
SCHEMBL98000 0.75 TDP1 (0.42) TDP1TP53CYP1A2CYP2A6ALDH1A1
SCHEMBL2949200 0.75 TDP1 (0.42) TDP1TP53CYP1A2CYP2A6ALDH1A1
SCHEMBL30150790 0.75 TDP1 (0.42) TDP1TP53CYP1A2CYP2A6ALDH1A1
SCHEMBL935347 0.75 TDP1 (0.42) TDP1TP53CYP1A2CYP2A6ALDH1A1
SCHEMBL30361887 0.75 TSHR (0.52) TDP1TP53CYP1A2CYP2A6ALDH1A1

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
CN-115505264-A Paste-like thermal interface material, preparation method thereof and electronic equipment 超聚变数字技术有限公司 2022-12-23 CN disclosed
CN-115353738-A Paste-like thermal interface material, preparation method thereof and electronic equipment 超聚变数字技术有限公司 2022-11-18 CN disclosed
US-20110087034-A1 Organic Semiconductor Material SUMITOMO CHEMICAL COMPANY LIMITED (JP) 2011-04-14 US disclosed
EP-2248818-A1 ORGANIC SEMICONDUCTOR MATERIAL Sumitomo Chemical Company, Limited (JP) 2010-11-10 EP disclosed
EP-0811669-B1 USE OF A FLUORSILICATE AS STAIN-PROOFING AGENT DAIKIN IND LTD (JP) 2004-02-04 EP disclosed
EP-0852251-B1 STAIN-PROOFING AGENT FOR PREVENTING ADHERENCE OF STAIN AND COMPOSITION FOR PAINTS DAIKIN IND LTD (JP) 2003-05-28 EP disclosed
US-6548614-B2 Film-forming organosilicate compounds DAIKIN INDUSTRIES, LTD. (JP) 2003-04-15 US disclosed
US-20010056166-A1 Stain-proofing agent for preventing adherence of stain MOHRI HARUHIKO (JP) 2001-12-27 US disclosed
US-6309708-B1 ORGANOMETALLIC POLYMERS DAIKIN INDUSTRIES, LTD. (JP) 2001-10-30 US disclosed
US-20010031850-A1 Stain-proofing agent for preventing adherence of stain and non-aqueous composition for paints containing said agent DAIKIN INDUSTRIES, LTD. (JP) 2001-10-18 US disclosed
US-6075110-A A NONAQUEOUS PAINT CONTAINS, A STAIN PROOFING AGENT SELECTED FROM ALKYLSILICATES CONTAINING FLUORO GROUPS, A RESIN, CURING AGENT AND CATALYSTS DAIKIN INDUSTRIES, LTD. (JP) 2000-06-13 US disclosed
EP-0852251-A1 POLLUTANT DEPOSITION INHIBITOR AND COATING MATERIAL COMPOSITION DAIKIN INDUSTRIES, LIMITED (JP) 1998-07-08 EP disclosed
EP-0811669-A1 ANTIFOULING AGENT AND NONAQUEOUS COATING COMPOSITION CONTAINING SAID AGENT DAIKIN INDUSTRIES, LIMITED (JP) 1997-12-10 EP disclosed
US-4576753-A MICROBIOCIDES, ANTIBIOTICS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1986-03-18 US disclosed
US-4472309-A ANTIMICROBIAL FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1984-09-18 US disclosed
US-4304718-A ANTIBIOTICS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1981-12-08 US disclosed
US-4264498-A REACTED WITH AN ACID, ITS ACID HALIDE, OR ANHYDRIDE IN THE PRESENCE OF BORON TRIHALIDE AND AN ORGANIC BASE FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1981-04-28 US disclosed
US-4181800-A ANTIBIOTICS FROM SUBSTITUTED PERHYDRO-S-TRIAZINES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1980-01-01 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-20010056166-A1 Stain-proofing agent for preventing adherence of stain MAPRE1, MAPRE2, PBRM1 TDP1 1589/4885TP53 2608/4885CYP1A2 816/4885
US-20110087034-A1 Organic Semiconductor Material OR10J3, TST, OR51E2 TDP1 2129/4885TP53 1684/4885CYP1A2 125/4885

“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.