SCHEMBL633436

SCHEMBL633436

CCCCCS(=O)(=O)On1nnc2ccccc21

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 6/20 0.50
CYP4Z1 Q86W10 5/20 0.46
TSHR P16473 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
RXFP1 Q9HBX9 1/20 0.44
ASAH1 Q13510 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
MGAM O43451 1/20 0.43
AMY1A P0DUB6 1/20 0.43
GAA P10253 1/20 0.43
SI P14410 1/20 0.43
MGAM2 Q2M2H8 1/20 0.43
KMT2A Q03164 2/20 0.41
MAPT P10636 1/20 0.41
ALDH1A1 P00352 1/20 0.40
HTT P42858 1/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40

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
SCHEMBL11450016 0.96 SLC9A1 (0.49) SLC9A1CYP4Z1TSHRNPSR1RXFP1
SCHEMBL7198576 0.90 TSHR (0.48) SLC9A1CYP4Z1TSHRNPSR1RXFP1
SCHEMBL14620598 0.79 ALDH1A1 (0.50) TSHRSMN1; SMN2GAAKMT2AMAPT
SCHEMBL11450048 0.78 ALDH1A1 (0.47) SLC9A1TSHRSMN1; SMN2KMT2AALDH1A1
SCHEMBL958454 0.76 TSHR (0.50) SLC9A1CYP4Z1TSHRNPSR1RXFP1
SCHEMBL4736616 0.76 SLC9A1 (0.54) SLC9A1CYP4Z1TSHRASAH1KMT2A
SCHEMBL11449443 0.76 TSHR (0.48) SLC9A1TSHRNPSR1RXFP1SMN1; SMN2
SCHEMBL6273531 0.76 TSHR (0.53) SLC9A1CYP4Z1TSHRNPSR1RXFP1
SCHEMBL19586683 0.76 NPSR1 (0.44) SLC9A1TSHRNPSR1RXFP1SMN1; SMN2
SCHEMBL5858382 0.76 ASAH1 (0.47) SLC9A1CYP4Z1TSHRNPSR1ASAH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2005041914-A1 COMPOSITION AND METHOD FOR PROTECTING BOTH NATURAL AND ARTIFICIAL HAIR COLOR FROM ULTRAVIOLET LIGHT DAMAGE ACCESS BUSINESS GROUP INTERNATIONAL LLC (US) 2005-05-12 WO claimed
US-20050089483-A1 Novel composition and method for protecting both natural and artificial hair color from ultraviolet light damage ACCESS BUSINESS GROUP INTERNATIONAL LLC 2005-04-28 US claimed
EP-2115073-B1 BLUE PHTHALOCYANINE PIGMENT COMPOSITION AND ITS PREPARATION BASF SE (DE) 2014-03-12 EP disclosed
US-8399161-B2 Transparent colourants and colourant compositions, and their use BASF SE (DE) 2013-03-19 US disclosed
EP-1984457-B1 BLUE COLOUR FILTERS WITH ENHANCED CONTRAST BASF SE (DE) 2013-01-09 EP disclosed
US-8148358-B2 Blue colour filters with enhanced contrast BASF SE (DE) 2012-04-03 US disclosed
EP-1523528-B1 POLYMERISABLE DIKETOPYRROLOPYRROLES, USE OF SUCH COMPOUNDS IN COLOUR FILTERS AND POLYMERS PREPARED FROM THESE COMPOUNDS BASF SE (DE) 2012-02-22 EP disclosed
US-7905952-B2 Blue phthalocyanine pigment composition and its preparation BASF SE (DE) 2011-03-15 US disclosed
EP-2125960-B1 TRANSPARENT COLOURANTS AND COLOURANT COMPOSITIONS, AND THEIR USE BASF SE (DE) 2011-01-26 EP disclosed
US-20100227199-A1 Blue Colour Filters with Enhanced Contrast CIBA CORPORATION 2010-09-09 US disclosed
US-7723530-B2 Use of polymerisable diketopyrrolopyrroles in colour filters CIBA SPECIALTY CHEMICALS CORPORATION (US) 2010-05-25 US disclosed
US-6406533-B2 6,13-DIHYDROQINACRIDONE DERIVATIVE IS DISSOLVED IN CONCENTRATED SULFURIC ACID, THE INTERMEDIATE SELECTED FROM A AROMATIC, CYCLO-HETERO ALIPHATIC GROUP OR HETEROAROMATIC GROUP AND PARA-FORMALDEHYDE IS ADDED, HEATING, PRECIPITATING CIBA SPECIALTY CHEMICALS CORPORATION 2002-06-18 US disclosed
US-20020016999-A1 Dispersant compositions improving the heat stability of transparent pigments CIBA SPECIALTY CHEMICALS CORP. 2002-02-14 US disclosed
WO-2002010288-A1 DISPERSANT COMPOSITIONS IMPROVING THE HEAT STABILITY OF TRANSPARENT PIGMENTS CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2002-02-07 WO disclosed
US-20010022150-A1 Suitable for synthesis of diketopyrrolopyrrole and quinacridone pigments and/or solid solutions; heat resistance; heat stability; rheology; flocculation BABLER FRIDOLIN (US) 2001-09-20 US disclosed
US-20010016655-A1 6,13-Dihydroquinacridone derivatives BABLER FRIDOLIN (US) 2001-08-23 US disclosed
US-6264733-B1 USEFUL WHEN SYNTHESIS OF PIGMENT; ADDED FOR HEAT STABILITY, RHEOLOGICAL AND FLOCCULATION PROPERTIES OF PIGMENT PARTICLES CIBA SPECIALTY CHEMICALS CORPORATION 2001-07-24 US disclosed
US-6225472-B1 CONTROLLS GROWTH/CRYSTALLIZAITON OF PIGMENT PARTICLES; FOR SYNTHESIS OR FINISHING OF ORGANIC PIGMENTS CIBA SPECIALTY CHEMICALS CORPORATION 2001-05-01 US disclosed
EP-1026207-A2 Pigment particle growth and/or crystal phase directors Ciba SC Holding AG (CH) 2000-08-09 EP disclosed
US-4242507-A Sulfonic acid esters FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1980-12-30 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 (3 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-20100227199-A1 Blue Colour Filters with Enhanced Contrast NR1H4, NR1D1, NR1D2 SLC9A1 397/4885CYP4Z1 546/4885TSHR 1213/4885
US-20050089483-A1 Novel composition and method for protecting both natural and artificial hair color from ultraviolet light damage TYR, MC1R, RAD50 SLC9A1 500/4885CYP4Z1 4162/4885TSHR 1066/4885
US-20010016655-A1 6,13-Dihydroquinacridone derivatives SDHA, NQO2, NDUFA6 SLC9A1 836/4885CYP4Z1 1963/4885TSHR 4164/4885

“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.