SCHEMBL6282600

SCHEMBL6282600

CN(C)c1ccc(C2c3ccc(N(C)C)cc3-c3cc(N(C)C)ccc32)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.44
TSHR P16473 5/20 0.44
ALOX15 P16050 3/20 0.44
HSD17B10 Q99714 2/20 0.44
TDP1 Q9NUW8 4/20 0.41
CYP3A4 P08684 3/20 0.41
MAPK1 P28482 2/20 0.41
TP53 P04637 1/20 0.41
PDGFRB P09619 1/20 0.38
MEN1 O00255 1/20 0.38
NPC1 O15118 1/20 0.38
HSP90AA1 P07900 1/20 0.38
RAB9A P51151 1/20 0.38
KMT2A Q03164 1/20 0.38
RECQL P46063 1/20 0.37
MAPT P10636 2/20 0.37
TERT O14746 1/20 0.36
APP P05067 1/20 0.36
HPGD P15428 1/20 0.36
HIF1A Q16665 1/20 0.36

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
SCHEMBL9803812 0.91 ALDH1A1 (0.48) ALDH1A1TSHRALOX15HSD17B10TDP1
SCHEMBL9803313 0.89 ALDH1A1 (0.40) ALDH1A1TSHRALOX15HSD17B10TDP1
SCHEMBL4859207 0.89 ALDH1A1 (0.38) ALDH1A1TSHRALOX15HSD17B10TDP1
SCHEMBL9803590 0.86 ALDH1A1 (0.37) ALDH1A1TSHRALOX15HSD17B10TDP1
SCHEMBL9803237 0.86 ALDH1A1 (0.34) ALDH1A1TSHRALOX15HSD17B10TDP1
SCHEMBL9803564 0.86 S100B (0.41) ALDH1A1TSHRALOX15HSD17B10TDP1
SCHEMBL9803217 0.86 ALDH1A1 (0.43) ALDH1A1TSHRALOX15HSD17B10TDP1
SCHEMBL9803614 0.86 IGLV6-57 (0.36) ALDH1A1TSHRALOX15HSD17B10TDP1
SCHEMBL4860561 0.86 SLC2A1 (0.49) ALDH1A1HSD17B10TDP1MAPK1TP53
SCHEMBL10774569 0.82 TSHR (0.35) ALDH1A1TSHRALOX15HSD17B10TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6914078-B2 Triarylmethane derivatives and their use as photochemotherapeutic agents WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2005-07-05 US disclosed
US-20030229147-A1 Triarylmethane derivatives and their use as photochemotherapeutic agents WISCONSIN ALUMNI RESEARCH FOUNDATION 2003-12-11 US disclosed
US-5130291-A HEAT-SENSITIVE RECORDING PAPER OSAKA SEALING PRINTING CO., LTD. (JP) 1992-07-14 US disclosed
EP-0232907-B1 HEAT-SENSITIVE RECORDING MATERIAL KANZAKI PAPER MANUFACTURING COMPANY LIMITED (JP) 1991-03-27 EP disclosed
EP-0133182-B1 OXIDATION-REDUCTION COLOR PRODUCTION-TYPE HEAT-SENSITIVE RECORDING UNIT MITSUI TOATSU CHEMICALS, Inc. (JP) 1989-03-15 EP disclosed
US-4761396-A BASIC PHTHALIDE DYE REACTS WITH FLUORENE DERIVATIVE AND P-PHENYLENEDIAMINE DERIVATIVE KANZAKI PAPER MANUFACTURING CO., LTD. (JP) 1988-08-02 US disclosed
EP-0232907-A2 Heat-sensitive recording material KANZAKI PAPER MANUFACTURING COMPANY LIMITED (JP) 1987-08-19 EP disclosed
EP-0055847-B1 PRESSURE SENSITIVE RECORDING UNIT MITSUI TOATSU CHEMICALS, Inc. (JP) 1986-04-02 EP disclosed
US-4561000-A METHINE-TYPE CHROMOGEN, BENZOQUINONE OXIDIZER, COLOR PRODUCTION SENSITIVITY REGULATOR, SUBSTRATE MITSUI TOATSU CHEMICALS, INC. (JP) 1985-12-24 US disclosed
EP-0058430-B1 DYESTUFF-CONTAINING MICROSCOPIC CAPSULE DISPERSION FOR RECORD MATERIALS MITSUI TOATSU CHEMICALS, Inc. (JP) 1985-12-04 EP disclosed
US-4398753-A METHINE-TYPE DYES AND QUINONE DERIVATIVE IN REDOX SYSTEM FOR CARBON-FREE REPRODUCTION MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1983-08-16 US disclosed
US-4384871-A Dyestuff-containing microscopic capsule dispersion for record materials MITSUI TOATSU CHEMICALS, INC. (JP) 1983-05-24 US disclosed
EP-0058430-A1 Dyestuff-containing microscopic capsule dispersion for record materials MITSUI TOATSU CHEMICALS, Inc. (JP) 1982-08-25 EP disclosed
EP-0055847-A1 Pressure sensitive recording unit MITSUI TOATSU CHEMICALS, Inc. (JP) 1982-07-14 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-20030229147-A1 Triarylmethane derivatives and their use as photochemotherapeutic agents HCCS, TYR, VHL ALDH1A1 130/4885TSHR 1252/4885ALOX15 1020/4885

“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.