SCHEMBL4399689

SCHEMBL4399689

CCCCCCCCCCCCCC[N]CCCCCCCCCCCCCC

nearest known ligand 0.61

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.61
THRB P10828 1/20 0.61
MEN1 O00255 3/20 0.52
KMT2A Q03164 3/20 0.52
NAAA Q02083 1/20 0.52
DNM1 Q05193 6/20 0.44
ALDH1A1 P00352 3/20 0.44
LMNA P02545 2/20 0.44
HSD17B10 Q99714 1/20 0.44
SLC22A1 O15245 1/20 0.44

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
SCHEMBL1691906 1.00 TSHR (0.61) TSHRTHRBMEN1KMT2ANAAA
SCHEMBL9206028 1.00 TSHR (0.61) TSHRTHRBMEN1KMT2ANAAA
SCHEMBL276911 1.00 TSHR (0.61) TSHRTHRBMEN1KMT2ANAAA
SCHEMBL7699808 1.00 TSHR (0.61) TSHRTHRBMEN1KMT2ANAAA
SCHEMBL107940 1.00 TSHR (0.61) TSHRTHRBMEN1KMT2ANAAA
SCHEMBL4389498 1.00 TSHR (0.61) TSHRTHRBMEN1KMT2ANAAA
SCHEMBL7697182 1.00 TSHR (0.61) TSHRTHRBMEN1KMT2ANAAA
SCHEMBL95733 1.00 TSHR (0.61) TSHRTHRBMEN1KMT2ANAAA
SCHEMBL277225 1.00 TSHR (0.61) TSHRTHRBMEN1KMT2ANAAA
SCHEMBL4395275 1.00 TSHR (0.61) TSHRTHRBMEN1KMT2ANAAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040020106-A1 Jet fuel compositions TACK ROBERT D (GB) 2004-02-05 US claimed
EP-1357168-A1 Jet fuel compositions Infineum International Limited (GB) 2003-10-29 EP claimed
EP-1357169-A2 Jet fuel compositions Infineum International Limited (GB) 2003-10-29 EP claimed
US-20030136046-A1 Fuel additive JACKSON GRAHAM (GB) 2003-07-24 US claimed
EP-1314771-A2 Fuel additive Infineum International Limited (GB) 2003-05-28 EP claimed
US-4844841-A Pyrenexulfonic acids useful in fluorescent lipid probes KOLLER ERNST (AT) 1989-07-04 US claimed
CN-110891985-B Use of specific aminosilyl monomers in rubber manufacture 盛禧奥欧洲有限责任公司 2023-02-17 CN disclosed
CN-109476841-B Novel polymer derivative and novel polymer derivative imaging probe using same 日本化药株式会社 2021-08-24 CN disclosed
CN-107249589-B Physiologically active substance-binding block copolymer 日本化药株式会社 2021-06-08 CN disclosed
US-10973762-B2 Active-targeting-type polymer derivative, composition containing said polymer derivative, and uses of said polymer derivative and said composition NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2021-04-13 US disclosed
EP-3380093-B1 BETA-HYDROXY KETONES AS TOPICAL AGENTS FOR THE PROPHYLAXIS OR TREATMENT OF PHOTODERMATOSES MERCK PATENT GMBH (DE) 2021-04-07 EP disclosed
US-10869937-B2 Polymer derivatives, and novel polymer derivative imaging probe using same NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2020-12-22 US disclosed
EP-3263107-B1 BLOCK COPOLYMER CONJUGATE OF PHYSIOLOGICALLY ACTIVE SUBSTANCE NIPPON KAYAKU KK (JP) 2020-11-11 EP disclosed
US-6057090-A Silver halide photographic material and hydroxamic acid-based compound used therefor FUJI PHOTO FILM CO., LTD. (JP) 2000-05-02 US disclosed
WO-2000009522-A1 METALLOCENYL-PHTHALOCYANINES CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2000-02-24 WO disclosed
US-5986042-A Cross-linked polymer MITSUI CHEMICALS, INC. (JP) 1999-11-16 US disclosed
EP-0866084-A2 Production process of cross-linked polyaspartic acid resin Mitsui Chemicals, Inc. (JP) 1998-09-23 EP disclosed
EP-0856539-A1 Cross-linked polymer Mitsui Chemicals, Inc. (JP) 1998-08-05 EP disclosed
EP-0767822-A1 USE OF LEUCOTRIARYLMETHANES FOR MARKING HYDROCARBONS BASF AKTIENGESELLSCHAFT (DE) 1997-04-16 EP disclosed
WO-1996000272-A1 USE OF LEUCOTRIARYLMETHANES FOR MARKING HYDROCARBONS BASF AKTIENGESELLSCHAFT (DE) 1996-01-04 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 (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-10869937-B2 Polymer derivatives, and novel polymer derivative imaging probe using same ERBB3, DDOST, EGFR TSHR 3601/4885THRB 2295/4885MEN1 835/4885
US-10973762-B2 Active-targeting-type polymer derivative, composition containing said polymer derivative, and uses of said polymer derivative and said composition CD68, HPGDS, MYD88 TSHR 4555/4885THRB 4127/4885MEN1 3802/4885

“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.