SCHEMBL5690898

SCHEMBL5690898

CCCCOCC[N]CCOCCCC

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.52
THRB P10828 2/20 0.46
HTT P42858 2/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
MAPT P10636 1/20 0.46
CYP3A4 P08684 2/20 0.44
ADRB2 P07550 1/20 0.39
ADRB1 P08588 1/20 0.39
ADRB3 P13945 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
CES2 O00748 2/20 0.38
HPGD P15428 1/20 0.38
ALDH1A1 P00352 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
USP2 O75604 1/20 0.35
CES1 P23141 1/20 0.34

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
SCHEMBL5933766 0.97 TSHR (0.50) TSHRTHRBHTTMEN1KMT2A
SCHEMBL5932167 0.97 TSHR (0.50) TSHRTHRBHTTMEN1KMT2A
SCHEMBL5932549 0.97 TSHR (0.50) TSHRTHRBHTTMEN1KMT2A
SCHEMBL6550126 0.92 THRB (0.56) TSHRTHRBHTTMEN1KMT2A
SCHEMBL5932553 0.92 THRB (0.56) TSHRTHRBHTTMEN1KMT2A
SCHEMBL5933725 0.92 THRB (0.56) TSHRTHRBHTTMEN1KMT2A
SCHEMBL5933437 0.92 THRB (0.56) TSHRTHRBHTTMEN1KMT2A
SCHEMBL5933192 0.92 THRB (0.56) TSHRTHRBHTTMEN1KMT2A
SCHEMBL5932812 0.92 THRB (0.56) TSHRTHRBHTTMEN1KMT2A
SCHEMBL5933588 0.90 TSHR (0.42) TSHRTHRBHTTMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4490176-A PRINTING INKS, PAINTS; PIGMENT, ALKYLBENZENE SULFONIC ACID, HYDROXYNAPHTHALENE BASF AKTIENGESELLSCHAFT (DE) 1984-12-25 US claimed
EP-0076995-B1 LIQUID STABLE PREPARATIONS AND THEIR USE BASF Aktiengesellschaft (DE) 1984-07-11 EP claimed
EP-0043932-B1 LIQUID, STABLE PREPARATIONS OF PHTHALOCYANINE PIGMENTS OR INDANTHRON AND THEIR USE BASF Aktiengesellschaft (DE) 1984-04-18 EP claimed
EP-0076995-A1 Liquid stable preparations and their use BASF Aktiengesellschaft (DE) 1983-04-20 EP claimed
US-4350534-A Fluid, stable formulations of copper phthalocyanine or indanthrone BASF AKTIENGESELLSCHAFT (DE) 1982-09-21 US claimed
EP-0043932-A1 Liquid, stable preparations of phthalocyanine pigments or indanthron and their use BASF Aktiengesellschaft (DE) 1982-01-20 EP claimed
US-7094516-B2 Benzobisazole compound and optical recording medium containing the compound MITSUI CHEMICALS, INC. (JP) 2006-08-22 US disclosed
EP-1247655-B1 OPTICAL RECORDING MEDIUM AND NOVEL AZAPORPHYRIN COMPOUNDS MITSUI CHEMICALS INC (JP) 2006-05-31 EP disclosed
US-20060088786-A1 Rewritable optical information recording medium, recording and reproducing methods, as well as recording and reproducing apparatus MITSUI CHEMICALS, INC. (JP) 2006-04-27 US disclosed
EP-1262966-B1 Optical recording medium and novel azaporphyrin compound MITSUI CHEMICALS INC (JP) 2006-04-12 EP disclosed
US-6969764-B2 Mono-, di-, and triazaporphyrin compounds optionally in the form of a metal or metalloid complex MITSUI CHEMICALS, INC. (JP) 2005-11-29 US disclosed
EP-1180765-B1 Optical recording medium and porphycene compound MITSUI CHEMICALS INC (JP) 2005-04-06 EP disclosed
EP-1484191-A1 REWRITABLE OPTICAL INFORMATION RECORDING MEDIUM AND RECORDING/REPRODUCING METHOD, RECORDING/REPRODUCING DEVICE Sony Corporation (JP) 2004-12-08 EP disclosed
EP-0090285-A2 Pigment preparations and their use in pigmenting heliographic and lac colours BASF Aktiengesellschaft (DE) 1983-10-05 EP disclosed
EP-0076995-A1 Liquid stable preparations and their use BASF Aktiengesellschaft (DE) 1983-04-20 EP disclosed
US-4350534-A Fluid, stable formulations of copper phthalocyanine or indanthrone BASF AKTIENGESELLSCHAFT (DE) 1982-09-21 US disclosed
EP-0002707-B1 NEW AMINOALKYL-BENZILKETALS AND THEIR USE AS INITIATORS FOR THE POLYMERISATION OF UNSATURATED COMPOUNDS CIBA-GEIGY AG (CH) 1982-04-07 EP disclosed
EP-0043932-A1 Liquid, stable preparations of phthalocyanine pigments or indanthron and their use BASF Aktiengesellschaft (DE) 1982-01-20 EP disclosed
US-4271294-A PHOTOINITIATORS CIBA-GEIGY CORPORATION (US) 1981-06-02 US disclosed
EP-0002707-A1 New aminoalkyl-benzilketals and their use as initiators for the polymerisation of unsaturated compounds CIBA-GEIGY AG (CH) 1979-07-11 EP 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 (1 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-20060088786-A1 Rewritable optical information recording medium, recording and reproducing methods, as well as recording and reproducing apparatus ALPG, TRPC6, GNRHR TSHR 1237/4885THRB 3407/4885HTT 2694/4885

“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.