SCHEMBL11937029

SCHEMBL11937029

Cc1sc2cc(C(=O)O)ccc2[n+]1C

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 3/20 0.45
▸ NPC1 O15118 2/20 0.45
▸ RAB9A P51151 2/20 0.45
▸ KDM4E B2RXH2 5/20 0.42
▸ LMNA P02545 1/20 0.42
▸ NFKB1 P19838 1/20 0.42
▸ NFKB2 Q00653 1/20 0.42
▸ RELA Q04206 1/20 0.42
▸ MYC P01106 4/20 0.41
▸ ALDH1A1 P00352 4/20 0.41
▸ TDP1 Q9NUW8 4/20 0.41
▸ MAPT P10636 2/20 0.41
▸ HSD17B10 Q99714 2/20 0.39
▸ ESR1 P03372 1/20 0.39
▸ ALOX15 P16050 1/20 0.39
▸ PTPN7 P35236 1/20 0.39
▸ HKDC1 Q2TB90 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ THRB P10828 1/20 0.38
▸ HPGD P15428 1/20 0.38

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
Iodide SCHEMBL8618523 0.81 KDM4E (0.40) SMN1; SMN2NPC1RAB9AKDM4ELMNA
SCHEMBL13043228 0.75 MAPT (0.59) SMN1; SMN2NPC1RAB9AKDM4ELMNA
SCHEMBL14159587 0.74 HSD17B10 (0.46) SMN1; SMN2NPC1RAB9AKDM4ELMNA
SCHEMBL11515408 0.73 LDHA (0.51) SMN1; SMN2NPC1RAB9AKDM4EMYC
SCHEMBL16574313 0.73 RAB9A (0.37) SMN1; SMN2NPC1RAB9AKDM4ELMNA
Iodide SCHEMBL31063723 0.73 MAPT (0.61) NPC1RAB9AKDM4ELMNAALDH1A1
Iodide SCHEMBL31063860 0.70 MAPT (0.47) SMN1; SMN2NPC1RAB9AKDM4ELMNA
Iodide SCHEMBL31063745 0.68 MAPT (0.76) SMN1; SMN2KDM4ELMNAALDH1A1TDP1
SCHEMBL839316 0.68 MAPT (0.52) SMN1; SMN2NPC1RAB9AKDM4EALDH1A1
SCHEMBL3966584 0.67 RAB9A (0.53) SMN1; SMN2NPC1RAB9AKDM4ELMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8735720-B2 Dye-sensitized photoelectric conversion device NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2014-05-27 — — US disclosed
US-8735720-B2 Dye-sensitized photoelectric conversion device NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2014-05-27 — — US disclosed
US-8227690-B2 Dye-sensitized photoelectric conversion device NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2012-07-24 — — US disclosed
US-8227690-B2 Dye-sensitized photoelectric conversion device NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2012-07-24 — — US disclosed
US-8022293-B2 Using oxide semiconductor particles sensitized with an N,N,N*,N*-tetraphenyl-p-phenylenediamine derivative methine dye; solar cells with high stability and conversion efficiency NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2011-09-20 — — US disclosed
US-8022293-B2 Using oxide semiconductor particles sensitized with an N,N,N*,N*-tetraphenyl-p-phenylenediamine derivative methine dye; solar cells with high stability and conversion efficiency NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2011-09-20 — — US disclosed
US-20090044857-A1 Dye-Sensitized Photoelectric Conversion Device NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2009-02-19 — — US disclosed
US-20090044857-A1 Dye-Sensitized Photoelectric Conversion Device NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2009-02-19 — — US disclosed
US-20080067476-A1 Dye-Sensitized Photoelectic Conversion Devices NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2008-03-20 — — US disclosed
US-20080067476-A1 Dye-Sensitized Photoelectic Conversion Devices NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2008-03-20 — — 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 (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-20090044857-A1 Dye-Sensitized Photoelectric Conversion Device CRY1, H1-5, CHRM1 SMN1; SMN2 3578/4885NPC1 4801/4885RAB9A 2539/4885

“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.

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