SCHEMBL1040798

SCHEMBL1040798

CCCCCCCC[N+](CCCCCCCC)CCCCCCCC

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.57
THRB P10828 1/20 0.57
ALDH1A1 P00352 4/20 0.52
HTT P42858 1/20 0.45
DNM1 Q05193 6/20 0.43
EPHX2 P34913 1/20 0.43
LMNA P02545 2/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
HSD17B10 Q99714 1/20 0.42
SLC22A1 O15245 1/20 0.42

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
SCHEMBL7694272 1.00 TSHR (0.57) TSHRTHRBALDH1A1HTTDNM1
SCHEMBL7698973 1.00 TSHR (0.57) TSHRTHRBALDH1A1HTTDNM1
SCHEMBL7696949 1.00 TSHR (0.57) TSHRTHRBALDH1A1HTTDNM1
SCHEMBL7702997 1.00 TSHR (0.57) TSHRTHRBALDH1A1HTTDNM1
SCHEMBL7694903 1.00 TSHR (0.57) TSHRTHRBALDH1A1HTTDNM1
SCHEMBL2727729 1.00 TSHR (0.57) TSHRTHRBALDH1A1HTTDNM1
SCHEMBL7702332 1.00 TSHR (0.57) TSHRTHRBALDH1A1HTTDNM1
SCHEMBL7696608 1.00 TSHR (0.57) TSHRTHRBALDH1A1HTTDNM1
SCHEMBL7700832 1.00 TSHR (0.57) TSHRTHRBALDH1A1HTTDNM1
SCHEMBL2818833 0.96 TSHR (0.50) TSHRTHRBALDH1A1HTTDNM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030064954-A1 Cationic amphiphilic 1,4-dihydropyridine derivatives useful for delivery of nucleotide containing compounds SPONDULI SERVICES, LTD. (AU) 2003-04-03 US claimed
US-11912950-B2 Use of nitrogen compounds quaternised with alkylene oxide and hydrocarbyl-substituted polycarboxylic acid as additives in fuels and lubricants BASF SE (DE) 2024-02-27 US disclosed
US-20210363451-A1 USE OF NITROGEN COMPOUNDS QUATERNISED WITH ALKYLENE OXIDE AND HYDROCARBYL-SUBSTITUTED POLYCARBOXYLIC ACID AS ADDITIVES IN FUELS AND LUBRICANTS BASF SE (DE) 2021-11-25 US disclosed
EP-3078717-B1 PHOTOBASE GENERATOR SAN APRO LTD (JP) 2020-05-20 EP disclosed
US-9933701-B2 Photobase generator SAN APRO LTD. (JP) 2018-04-03 US disclosed
US-20160299429-A1 PHOTOBASE GENERATOR SAN APRO LTD. (JP) 2016-10-13 US disclosed
EP-3078717-A1 PHOTOBASE GENERATOR San-Apro Limited (JP) 2016-10-12 EP disclosed
EP-2980180-A1 PHOTOBASE GENERATOR San-Apro Ltd. (JP) 2016-02-03 EP disclosed
US-20160009737-A1 PHOTOBASE GENERATOR SAN-APRO LTD. (JP) 2016-01-14 US disclosed
EP-2270114-B1 PHOTOBASE GENERATOR SAN APRO LTD (JP) 2014-07-09 EP disclosed
US-20110028585-A1 PHOTOBASE GENERATOR SAN-APRO LIMITED (JP) 2011-02-03 US disclosed
EP-2270114-A1 PHOTOBASE GENERATOR San-Apro Limited (JP) 2011-01-05 EP disclosed
US-20030064954-A1 Cationic amphiphilic 1,4-dihydropyridine derivatives useful for delivery of nucleotide containing compounds SPONDULI SERVICES, LTD. (AU) 2003-04-03 US disclosed
US-6346569-B1 DISPERSING FEED POLYSUCCINIMIDE WITH DISPERSANT, REACTING DISPERSED POLYSUCCINIMIDE WITH CROSS-LINKING AGENT MITSUI CHEMICALS, INC. (JP) 2002-02-12 US disclosed
US-6072024-A Production process of cross-linked polyaspartic acid resin MITSUI CHEMICALS, INC. (JP) 2000-06-06 US 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
US-4508602-A CALIBRATION OF ELECTROLYTIC CELL BY MEASUREMENT OF RATIO OF ALKALIMETAL CHLORIDES TO CHLORATES OLIN CORPORATION (US) 1985-04-02 US disclosed
US-4434033-A ANALYZING RATIOS, ADJUSTING, TO PERMIT CONTINUOUS PROCESSING OLIN CORPORATION (US) 1984-02-28 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 (6 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-20160299429-A1 PHOTOBASE GENERATOR RER1, ARL1, ARF1 TSHR 2424/4885THRB 1987/4885ALDH1A1 1895/4885
US-20030064954-A1 Cationic amphiphilic 1,4-dihydropyridine derivatives useful for delivery of nucleotide containing compounds ACIN1, DNA2, KPNA1 TSHR 4680/4885THRB 4695/4885ALDH1A1 2344/4885
US-11912950-B2 Use of nitrogen compounds quaternised with alkylene oxide and hydrocarbyl-substituted polycarboxylic acid as additives in fuels and lubricants DGKI, DERL1, DEK TSHR 4174/4885THRB 3491/4885ALDH1A1 3085/4885
US-20110028585-A1 PHOTOBASE GENERATOR CCKBR, XDH, PPOX TSHR 2002/4885THRB 2649/4885ALDH1A1 1530/4885
US-20210363451-A1 USE OF NITROGEN COMPOUNDS QUATERNISED WITH ALKYLENE OXIDE AND HYDROCARBYL-SUBSTITUTED POLYCARBOXYLIC ACID AS ADDITIVES IN FUELS AND LUBRICANTS DGKI, DERL1, DEK TSHR 4174/4885THRB 3491/4885ALDH1A1 3085/4885
US-20160009737-A1 PHOTOBASE GENERATOR PSMC6, ARCN1, CRY1 TSHR 2438/4885THRB 2456/4885ALDH1A1 1529/4885

“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.