SCHEMBL1043264

SCHEMBL1043264

Clc1ccc2ccc(OCc3ccccc3)cc2n1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.66
ALOX5 P09917 1/20 0.60
NPC1 O15118 2/20 0.51
RAB9A P51151 2/20 0.51
PRMT5 O14744 2/20 0.50
MAOB P27338 6/20 0.48
MAOA P21397 2/20 0.48
MEN1 O00255 1/20 0.48
CA12 O43570 1/20 0.48
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
CA3 P07451 1/20 0.48
CA4 P22748 1/20 0.48
CA6 P23280 1/20 0.48
CA7 P43166 1/20 0.48
MTNR1A P48039 1/20 0.48
KMT2A Q03164 1/20 0.48
CA9 Q16790 1/20 0.48
CA14 Q9ULX7 1/20 0.48
NOS1 P29475 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
SCHEMBL1550777 0.89 ALOX5 (0.63) CYP3A4ALOX5NPC1RAB9APRMT5
SCHEMBL9015202 0.81 CYP3A4 (0.66) CYP3A4ALOX5NPC1RAB9AMAOB
SCHEMBL23273961 0.81 CYP3A4 (0.54) CYP3A4ALOX5NPC1RAB9APRMT5
SCHEMBL29971250 0.81 CYP3A4 (0.54) CYP3A4ALOX5NPC1RAB9APRMT5
SCHEMBL841728 0.79 CYP3A4 (1.00) CYP3A4ALOX5NPC1RAB9APRMT5
SCHEMBL30125417 0.79 CYP3A4 (1.00) CYP3A4ALOX5NPC1RAB9APRMT5
SCHEMBL19101889 0.79 CYP3A4 (0.43) CYP3A4ALOX5PRMT5CA1CA2
SCHEMBL1042727 0.79 MEN1 (0.50) CYP3A4MEN1KMT2ALMNAGAA
SCHEMBL31580904 0.79 CYP3A4 (0.62) CYP3A4ALOX5NPC1RAB9ALMNA
SCHEMBL24637914 0.79 SMN1; SMN2 (0.51) CYP3A4ALOX5NPC1RAB9APRMT5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105037266-A Antibacterial chloroxoquinoline derivative WANG ZIHOU 2015-11-11 CN claimed
CN-105017145-A Chloroxoquinoline derivative with anti-tumor activity WANG ZIHOU 2015-11-04 CN claimed
CN-105017145-B 7-chloro-4-oxo-quinoline derivative with antitumor activity 王子厚 2017-12-05 CN disclosed
CN-105037266-B 7-chloro-4-oxo-quinoline derivative for antibacterial 王子厚 2017-07-28 CN disclosed
CN-105037266-A Antibacterial chloroxoquinoline derivative WANG ZIHOU 2015-11-11 CN disclosed
CN-105017145-A Chloroxoquinoline derivative with anti-tumor activity WANG ZIHOU 2015-11-04 CN disclosed
CN-103864681-B Chloroxoquinoline derivatives for antibacterial use WANG ZIHOU (CN) 2015-09-02 CN disclosed
CN-103864680-B Chloroxoquinoline derivative with antineoplastic activity WANG ZIHOU (CN) 2015-09-02 CN disclosed
EP-2270006-A1 Pyridazine derivatives useful as vanilloid receptor ligands Amgen, Inc (US) 2011-01-05 EP disclosed
US-7332511-B2 Vanilloid receptor ligands and their use in treatments AMGEN INC. (US) 2008-02-19 US disclosed
US-7332511-B2 Vanilloid receptor ligands and their use in treatments AMGEN INC. (US) 2008-02-19 US disclosed
US-7148221-B2 Vanilloid receptor ligands and their use in treatments AMGEN INC. (US) 2006-12-12 US disclosed
US-7144888-B2 Vanilloid receptor ligands and their use in treatments AMGEN INC. (US) 2006-12-05 US disclosed
EP-1717220-A2 Vanilloid receptor ligands and their use in treatments Amgen, Inc (US) 2006-11-02 EP disclosed
EP-1688408-A2 Vanilloid receptor ligands and their use in treatments Amgen, Inc (US) 2006-08-09 EP disclosed
US-20050277631-A1 Vanilloid receptor ligands and their use in treatments AMGEN INC. 2005-12-15 US disclosed
US-20050272777-A1 Vanilloid receptor ligands and their use in treatments AMGEN INC. 2005-12-08 US disclosed
EP-1546116-A1 VANILLOID RECEPTOR LIGANDS AND THEIR USE IN TREATMENTS Amgen Inc. (US) 2005-06-29 EP disclosed
US-20040082780-A1 Vanilloid receptor ligands and their use in treatments AMGEN, INC. 2004-04-29 US disclosed
WO-2004014871-A1 VANILLOID RECEPTOR LIGANDS AND THEIR USE IN TREATMENTS AMGEN INC. (US) 2004-02-19 WO 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-20050272777-A1 Vanilloid receptor ligands and their use in treatments TRPV1, TRPV2, TRPV3 CYP3A4 1962/4885ALOX5 839/4885NPC1 2938/4885
US-20050277631-A1 Vanilloid receptor ligands and their use in treatments TRPV1, TRPV2, TRPV3 CYP3A4 1962/4885ALOX5 839/4885NPC1 2938/4885
US-20040082780-A1 Vanilloid receptor ligands and their use in treatments TRPV1, TRPV2, TRPV3 CYP3A4 2078/4885ALOX5 854/4885NPC1 2453/4885

“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.