SCHEMBL1781797

SCHEMBL1781797

CCCNCCCCCCNCCC

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.69
ALDH1A1 P00352 1/20 0.69
PAOX Q6QHF9 1/20 0.56
CYP2C19 P33261 2/20 0.56
CYP1A2 P05177 1/20 0.56
MEN1 O00255 1/20 0.50
GLA P06280 1/20 0.50
KMT2A Q03164 1/20 0.50
S1PR2 O95136 5/20 0.46
S1PR4 O95977 5/20 0.46
S1PR1 P21453 5/20 0.46
S1PR3 Q99500 5/20 0.46
S1PR5 Q9H228 1/20 0.46
EPHX1 P07099 2/20 0.46
ADH1B P00325 2/20 0.46
ADH1A P07327 2/20 0.46
ADH7 P40394 2/20 0.46
ADH1C P00326 1/20 0.46
ADH4 P08319 1/20 0.46
HRH4 Q9H3N8 1/20 0.45

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
SCHEMBL11508516 1.00 TSHR (0.69) TSHRALDH1A1PAOXCYP2C19CYP1A2
SCHEMBL4211605 1.00 TSHR (0.69) TSHRALDH1A1PAOXCYP2C19CYP1A2
SCHEMBL7512916 1.00 TSHR (0.69) TSHRALDH1A1PAOXCYP2C19CYP1A2
SCHEMBL1248078 1.00 TSHR (0.69) TSHRALDH1A1PAOXCYP2C19CYP1A2
SCHEMBL11508173 1.00 TSHR (0.69) TSHRALDH1A1PAOXCYP2C19CYP1A2
SCHEMBL2639821 0.97 TSHR (0.65) TSHRALDH1A1PAOXCYP2C19CYP1A2
Bromide SCHEMBL7596439 0.97 TSHR (0.65) TSHRALDH1A1PAOXCYP2C19CYP1A2
Hydrochloric Acid SCHEMBL7512068 0.97 TSHR (0.65) TSHRALDH1A1PAOXCYP2C19CYP1A2
Hydrochloric Acid SCHEMBL7512398 0.97 TSHR (0.65) TSHRALDH1A1PAOXCYP2C19CYP1A2
Bromide SCHEMBL7601203 0.97 TSHR (0.65) TSHRALDH1A1PAOXCYP2C19CYP1A2

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 17 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022216754-A1 THERMAL INTERFACE MATERIALS BY POLYMERIZATION INDUCED PHASE SEPARATION ADAPTIVE 3D TECHNOLOGIES, LLC (US) 2022-10-13 WO disclosed
US-11147833-B2 Therapeutic agent for hyperphosphatemia FUJIFILM CORPORATION (JP) 2021-10-19 US disclosed
US-20190321392-A1 THERAPEUTIC AGENT FOR HYPERPHOSPHATEMIA FUJIFILM CORPORATION (JP) 2019-10-24 US disclosed
EP-1828354-B1 HYDROCARBYL SUCCINIC ACID AND HYDROCARBYLSUCCINIC ACID DERIVATIVES AS FRICTION MODIFIERS BASF SE (DE) 2017-09-06 EP disclosed
US-20110117164-A1 Use of Additive Sites to Control Nitric Oxide Release from Nitric Oxide Donors Contained within Polymers NATIONAL INSTITUTES OF HEALTH-DIRECTOR DEITR 2011-05-19 US disclosed
WO-2009135877-A1 DIBLOCK COPOLYMER-SUBSTITUTED SUCCINIC ACID DERIVATIVES BASF SE (DE) 2009-11-12 WO disclosed
EP-1828354-A1 HYDROCARBYL SUCCINIC ACID AND HYDROCARBYLSUCCINIC ACID DERIVATIVES AS FRICTION MODIFIERS BASF AKTIENGESELLSCHAFT (DE) 2007-09-05 EP disclosed
WO-2006063770-A1 HYDROCARBYL SUCCINIC ACID AND HYDROCARBYLSUCCINIC ACID DERIVATIVES AS FRICTION MODIFIERS BASF AKTIENGESELLSCHAFT (DE) 2006-06-22 WO disclosed
EP-1669433-A1 Hydrocarbyl succinic acid and hydrocarbylsuccinic acid derivatives as friction modifiers BASF AKTIENGESELLSCHAFT (DE) 2006-06-14 EP disclosed
US-20060008529-A1 Use of additive sites to control nitric oxide release from nitric oxide donors contained within polymers NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2006-01-12 US disclosed
EP-0001797-B1 PROCESS FOR THE ISOLATION OF CEPHALOSPORIN C, ITS SALTS AND ITS DERIVATIVES, FROM CULTURE MEDIA AND SOLUTIONS HOECHST AKTIENGESELLSCHAFT (DE) 1981-06-17 EP disclosed
US-4204058-A Process for obtaining cephalosporin C and the salts and derivatives thereof from culture filtrates or culture solutions HOECHST AKTIENGESELLSCHAFT (DE) 1980-05-20 US disclosed
EP-0001797-A1 Process for the isolation of cephalosporin C, its salts and its derivatives, from culture media and solutions HOECHST AKTIENGESELLSCHAFT (DE) 1979-05-16 EP disclosed
US-4140860-A BACTERICIDES STERLING DRUG INC. (US) 1979-02-20 US disclosed
US-4119668-A ANTIBACTERIAL AGENTS STERLING DRUG INC. (US) 1978-10-10 US disclosed
US-4085144-A ANTIBACTERIAL STERLING DRUG INC. (US) 1978-04-18 US disclosed
US-4022833-A ANTIBACTERIAL AGENTS STERLING DRUG INC. (US) 1977-05-10 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 (4 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-20110117164-A1 Use of Additive Sites to Control Nitric Oxide Release from Nitric Oxide Donors Contained within Polymers NOS1, NOS2, NOS3 TSHR 4279/4885ALDH1A1 1430/4885PAOX 1273/4885
US-20190321392-A1 THERAPEUTIC AGENT FOR HYPERPHOSPHATEMIA PHPT1, PPIP5K2, PTH1R TSHR 3230/4885ALDH1A1 3982/4885PAOX 1561/4885
US-20060008529-A1 Use of additive sites to control nitric oxide release from nitric oxide donors contained within polymers NOS1, NOS2, NOS3 TSHR 4279/4885ALDH1A1 1430/4885PAOX 1273/4885
US-11147833-B2 Therapeutic agent for hyperphosphatemia PHPT1, PPIP5K2, PTH1R TSHR 3230/4885ALDH1A1 3982/4885PAOX 1561/4885

“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.