SCHEMBL1133367

SCHEMBL1133367

Nc1nc2ccccc2cc1O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.59
KDM4E B2RXH2 6/20 0.59
GAA P10253 4/20 0.59
HPGD P15428 4/20 0.59
STAT3 P40763 1/20 0.59
IKBKB O14920 1/20 0.56
TLR8 Q9NR97 7/20 0.53
GLA P06280 3/20 0.52
MAPT P10636 2/20 0.52
ACHE P22303 1/20 0.52
HSD17B10 Q99714 1/20 0.52
NPC1 O15118 3/20 0.49
RAB9A P51151 3/20 0.49
KMT2A Q03164 2/20 0.49
MEN1 O00255 1/20 0.49
HTR3A P46098 1/20 0.48
ATM Q13315 1/20 0.47
LMNA P02545 1/20 0.47
POLB P06746 1/20 0.47
PTBP1 P26599 1/20 0.47

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
Valine SCHEMBL9374776 0.80 IKBKB (0.47) ALDH1A1KDM4EGAAHPGDSTAT3
SCHEMBL359102 0.77 TLR8 (0.57) ALDH1A1KDM4EGAAHPGDIKBKB
SCHEMBL29454362 0.77 TLR8 (0.57) ALDH1A1KDM4EGAAHPGDIKBKB
SCHEMBL38652592 0.77 ALDH1A1 (0.63) ALDH1A1KDM4EGAAHPGDSTAT3
SCHEMBL5702613 0.77 ALDH1A1 (0.67) ALDH1A1KDM4EGAAHPGDSTAT3
SCHEMBL209889 0.77 ALDH1A1 (0.63) ALDH1A1KDM4EGAAHPGDSTAT3
SCHEMBL7159163 0.77 ALDH1A1 (0.63) ALDH1A1KDM4EGAAHPGDSTAT3
SCHEMBL17960034 0.76 ALDH1A1 (0.52) ALDH1A1KDM4EGAAHPGDSTAT3
SCHEMBL16990165 0.76 ALDH1A1 (0.61) ALDH1A1KDM4EGAAHPGDSTAT3
Hydrochloric Acid SCHEMBL5594900 0.76 ALDH1A1 (0.61) ALDH1A1KDM4EGAAHPGDSTAT3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109860393-B Amino hydroxyquinoline compound-doped perovskite type solar cell and preparation method thereof 暨南大学 2021-07-27 CN claimed
CN-109860393-A A kind of Ca-Ti ore type solar battery and preparation method thereof adulterating hydroxy amino quinolines 暨南大学 2019-06-07 CN claimed
CN-109860393-B Amino hydroxyquinoline compound-doped perovskite type solar cell and preparation method thereof 暨南大学 2021-07-27 CN disclosed
CN-109860393-B Amino hydroxyquinoline compound-doped perovskite type solar cell and preparation method thereof 暨南大学 2021-07-27 CN disclosed
CN-109860393-A A kind of Ca-Ti ore type solar battery and preparation method thereof adulterating hydroxy amino quinolines 暨南大学 2019-06-07 CN disclosed
CN-109860393-A A kind of Ca-Ti ore type solar battery and preparation method thereof adulterating hydroxy amino quinolines 暨南大学 2019-06-07 CN disclosed
CN-109860393-A A kind of Ca-Ti ore type solar battery and preparation method thereof adulterating hydroxy amino quinolines 暨南大学 2019-06-07 CN disclosed
US-20160356681-A1 MODIFIED CARBOCYANINE DYES AND THEIR CONJUGATES Life Technologies Corporation 2016-12-08 US disclosed
US-9423323-B2 Modified carbocyanine dyes and their conjugates Life Technologies Corporation (US) 2016-08-23 US disclosed
US-20150247785-A1 MODIFIED CARBOCYANINE DYES AND THEIR CONJUGATES Life Technologies Corporation 2015-09-03 US disclosed
US-20150218380-A1 MODIFIED CARBOCYANINE DYES AND THEIR CONJUGATES Life Technologies Corporation 2015-08-06 US disclosed
US-20060099638-A1 Modified carbocyanine dyes and their conjugates MOLECULAR PROBES, INC. 2006-05-11 US disclosed
US-20060004188-A1 Intermediates and the synthesis of modified carbocyanine dyes and their conjugates MOLECULAR PROBES, INC. 2006-01-05 US disclosed
US-6977305-B2 Modified carbocyanine dyes and their conjugates MOLECULAR PROBES, INC. (US) 2005-12-20 US disclosed
US-6974873-B2 Modified carbocyanine dyes and their conjugates MOLECULAR PROBES, INC. (US) 2005-12-13 US disclosed
US-20020077487-A1 Modified carbocyanine dyes and their conjugates MOLECULAR PROBES, INC. 2002-06-20 US disclosed
US-20020064794-A1 Modified carbocyanine dyes and their conjugates MOLECULAR PROBES, INC. 2002-05-30 US disclosed
US-5969077-A Polysiloxanes containing heterocyclic functions, their preparation and use WACKER-CHEMIE GMBH (DE) 1999-10-19 US disclosed
EP-0906930-A1 Polysiloxanes with heterocyclic functions, their preparation and use Wacker-Chemie GmbH (DE) 1999-04-07 EP disclosed
US-3963694-A AZO PIGMENTS, POLYESTERS, CELLULOSE ETHERS AND ESTERS CIBA-GEIGY CORPORATION (US) 1976-06-15 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 (6 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-20020077487-A1 Modified carbocyanine dyes and their conjugates IK, CBR3, DRD5 ALDH1A1 385/4885KDM4E 2829/4885GAA 4104/4885
US-20160356681-A1 MODIFIED CARBOCYANINE DYES AND THEIR CONJUGATES IK, CBR3, DRD5 ALDH1A1 385/4885KDM4E 2829/4885GAA 4104/4885
US-20150218380-A1 MODIFIED CARBOCYANINE DYES AND THEIR CONJUGATES IK, CBR3, DRD5 ALDH1A1 385/4885KDM4E 2829/4885GAA 4104/4885
US-20150247785-A1 MODIFIED CARBOCYANINE DYES AND THEIR CONJUGATES IK, CBR3, DRD5 ALDH1A1 385/4885KDM4E 2829/4885GAA 4104/4885
US-20060004188-A1 Intermediates and the synthesis of modified carbocyanine dyes and their conjugates CBR3, IK, CYBA ALDH1A1 181/4885KDM4E 2903/4885GAA 3983/4885
US-20060099638-A1 Modified carbocyanine dyes and their conjugates IK, CBR3, DRD5 ALDH1A1 385/4885KDM4E 2829/4885GAA 4104/4885

“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.