SCHEMBL2298602

SCHEMBL2298602

CCN(CC)c1ccc(/C=C/c2ccc(/C=C/c3ccc(N(CC)CC)cc3)cc2)cc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.71
ALDH3A1 P30838 1/20 0.71
ALDH1A3 P47895 1/20 0.71
MAPT P10636 9/20 0.63
MEN1 O00255 7/20 0.63
KMT2A Q03164 7/20 0.63
LMNA P02545 3/20 0.63
KDM4E B2RXH2 3/20 0.61
GAA P10253 3/20 0.61
MAPK1 P28482 6/20 0.56
TDP1 Q9NUW8 5/20 0.56
L3MBTL1 Q9Y468 4/20 0.56
CYP3A4 P08684 2/20 0.56
RECQL P46063 2/20 0.56
GFER P55789 2/20 0.56
PSMD14 O00487 1/20 0.56
TSHR P16473 1/20 0.56
NPSR1 Q6W5P4 4/20 0.54
BCHE P06276 2/20 0.54
ACHE P22303 2/20 0.54

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
SCHEMBL8171052 1.00 ALDH1A1 (0.71) ALDH1A1ALDH3A1ALDH1A3MAPTMEN1
SCHEMBL2298605 1.00 ALDH1A1 (0.71) ALDH1A1ALDH3A1ALDH1A3MAPTMEN1
SCHEMBL8171054 1.00 ALDH1A1 (0.71) ALDH1A1ALDH3A1ALDH1A3MAPTMEN1
SCHEMBL14283633 0.95 ALDH1A1 (0.65) ALDH1A1ALDH3A1ALDH1A3MAPTMEN1
SCHEMBL21594514 0.93 ALDH1A1 (0.63) ALDH1A1ALDH3A1ALDH1A3MAPTMEN1
SCHEMBL4243407 0.91 ALDH1A1 (0.61) ALDH1A1ALDH3A1ALDH1A3MAPTMEN1
SCHEMBL21591022 0.91 ALDH1A1 (0.88) ALDH1A1ALDH3A1ALDH1A3MAPTMEN1
SCHEMBL18159319 0.91 ALDH1A1 (0.61) ALDH1A1ALDH3A1ALDH1A3MAPTMEN1
SCHEMBL21594497 0.91 ALDH1A1 (0.61) ALDH1A1ALDH3A1ALDH1A3MAPTMEN1
SCHEMBL9192952 0.91 ALDH1A1 (0.61) ALDH1A1ALDH3A1ALDH1A3MAPTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210284608-A1 OPTICAL DATA COMMUNICATION SYSTEM COMPRISING PARA-PHENYLENEVINYLENES AND SPECIFIC PARA-PHENYLENEVINYLENES BASF SE (DE) 2021-09-16 US disclosed
WO-2019238532-A1 OPTICAL DATA COMMUNICATION SYSTEM COMPRISING PARA-PHENYLENEVINYLENES AND SPECIFIC PARA-PHENYLENEVINYLENES BASF SE (DE) 2019-12-19 WO disclosed
US-20170329220-A1 PHOTOSENSITIVE RESIN COMPOSITION, PHOTOSENSITIVE ELEMENT, CURED PRODUCT, SEMICONDUCTOR DEVICE, METHOD FOR FORMING RESIST PATTERN, AND METHOD FOR PRODUCING CIRCUIT SUBSTRATE HITACHI CHEMICAL COMPANY, LTD. (JP) 2017-11-16 US disclosed
US-9740117-B2 Electrophotographic photosensitive member, process cartridge, electrophotographic apparatus, and condensed polycyclic aromatic compound CANON KABUSHIKI KAISHA (JP) 2017-08-22 US disclosed
US-9740117-B2 Electrophotographic photosensitive member, process cartridge, electrophotographic apparatus, and condensed polycyclic aromatic compound CANON KABUSHIKI KAISHA (JP) 2017-08-22 US disclosed
US-20160011529-A1 ELECTROPHOTOGRAPHIC PHOTOSENSITIVE MEMBER, PROCESS CARTRIDGE, ELECTROPHOTOGRAPHIC APPARATUS, AND CONDENSED POLYCYCLIC AROMATIC COMPOUND CANON KABUSHIKI KAISHA (JP) 2016-01-14 US disclosed
US-20160011529-A1 ELECTROPHOTOGRAPHIC PHOTOSENSITIVE MEMBER, PROCESS CARTRIDGE, ELECTROPHOTOGRAPHIC APPARATUS, AND CONDENSED POLYCYCLIC AROMATIC COMPOUND CANON KABUSHIKI KAISHA (JP) 2016-01-14 US disclosed
US-8889324-B2 Image bearing member, image forming method, image forming apparatus, and process cartridge RICOH COMPANY, LTD. (JP) 2014-11-18 US disclosed
US-20110200925-A1 IMAGE BEARING MEMBER, IMAGE FORMING METHOD, IMAGE FORMING APPARATUS, AND PROCESS CARTRIDGE RICOH COMPANY, LTD. (JP) 2011-08-18 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 (2 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-20210284608-A1 OPTICAL DATA COMMUNICATION SYSTEM COMPRISING PARA-PHENYLENEVINYLENES AND SPECIFIC PARA-PHENYLENEVINYLENES OR10J3, OXER1, CDC73 ALDH1A1 3708/4885ALDH3A1 3728/4885ALDH1A3 953/4885
US-20160011529-A1 ELECTROPHOTOGRAPHIC PHOTOSENSITIVE MEMBER, PROCESS CARTRIDGE, ELECTROPHOTOGRAPHIC APPARATUS, AND CONDENSED POLYCYCLIC AROMATIC COMPOUND SLC18A1, TRPA1, PAH ALDH1A1 571/4885ALDH3A1 614/4885ALDH1A3 1266/4885

“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.