SCHEMBL537267

SCHEMBL537267

OCC(CO)c1ccc(Br)cc1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 1/20 0.42
HTR2A P28223 1/20 0.41
CYP1A2 P05177 1/20 0.40
ALOX15 P16050 1/20 0.39
CA1 P00915 2/20 0.37
CA2 P00918 2/20 0.37
CYP2C19 P33261 1/20 0.35
ALOX5 P09917 1/20 0.35
CNR1 P21554 1/20 0.35
CNR2 P34972 1/20 0.35
SLC6A2 P23975 1/20 0.35
SLC6A4 P31645 1/20 0.35
SLC6A3 Q01959 1/20 0.35

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
SCHEMBL3857347 0.86 HDAC8 (0.44) HTR2ACYP1A2ALOX15CYP2C19ALOX5
SCHEMBL8164326 0.86 HDAC8 (0.44) HTR2ACYP1A2ALOX15CYP2C19ALOX5
SCHEMBL28830508 0.83 HTR2A (0.34) CYP2A6HTR2ACYP1A2ALOX15ALOX5
SCHEMBL28830511 0.83 HTR2A (0.34) CYP2A6HTR2ACYP1A2ALOX15ALOX5
SCHEMBL10833320 0.81 TAAR1 (0.42) HTR2ACNR1CNR2
SCHEMBL1241307 0.81 CHRM2 (0.39) HTR2ACYP1A2ALOX5SLC6A2SLC6A4
SCHEMBL11856343 0.80 NR1I2 (0.37) CYP1A2CYP2C19ALOX5
SCHEMBL19262248 0.80 KMT2A (0.33) HTR2ACYP1A2ALOX5CNR1
SCHEMBL15348656 0.78 CYP2C19 (0.38) HTR2ACYP1A2CYP2C19ALOX5
SCHEMBL1306565 0.77 IGF1R (0.42) CYP2A6HTR2ACYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2975022-B1 NOVEL HYDROXAMIC ACID DERIVATIVE OR SALT THEREOF FUJIFILM TOYAMA CHEMICAL CO LTD (JP) 2019-05-08 EP disclosed
EP-2975022-B1 NOVEL HYDROXAMIC ACID DERIVATIVE OR SALT THEREOF FUJIFILM TOYAMA CHEMICAL CO LTD (JP) 2019-05-08 EP disclosed
US-9862676-B2 Hydroxamic acid derivative or salt thereof TOYAMA CHEMICAL CO., LTD. (JP) 2018-01-09 US disclosed
US-9862676-B2 Hydroxamic acid derivative or salt thereof TOYAMA CHEMICAL CO., LTD. (JP) 2018-01-09 US disclosed
US-9296726-B2 Inhibitors of c-fms kinase JANSSEN PHARMACEUTICA NV (BE) 2016-03-29 US disclosed
US-20160039751-A1 NOVEL HYDROXAMIC ACID DERIVATIVE OR SALT THEREOF TOYAMA CHEMICAL CO., LTD. (JP) 2016-02-11 US disclosed
US-20160039751-A1 NOVEL HYDROXAMIC ACID DERIVATIVE OR SALT THEREOF TOYAMA CHEMICAL CO., LTD. (JP) 2016-02-11 US disclosed
US-20160039751-A1 NOVEL HYDROXAMIC ACID DERIVATIVE OR SALT THEREOF TOYAMA CHEMICAL CO., LTD. (JP) 2016-02-11 US disclosed
EP-2975022-A1 NOVEL HYDROXAMIC ACID DERIVATIVE OR SALT THEREOF Toyama Chemical Co., Ltd. (JP) 2016-01-20 EP disclosed
EP-2975022-A1 NOVEL HYDROXAMIC ACID DERIVATIVE OR SALT THEREOF Toyama Chemical Co., Ltd. (JP) 2016-01-20 EP disclosed
US-6998412-B2 Heterocyclic compounds NIPPON SHINYAKU CO., LTD. (JP) 2006-02-14 US disclosed
US-20050009892-A1 Heterocyclic compounds NIPPON SHINYAKU CO., LTD. (JP) 2005-01-13 US disclosed
US-20050009785-A1 Heterocyclic compounds KUWABARA KENJI (JP) 2005-01-13 US disclosed
US-20040162325-A1 Heterocyclic compounds KUWABARA KENJI (JP) 2004-08-19 US disclosed
US-20030166697-A1 Heterocyclic compounds NIPPON SHINYAKU CO., LTD. (JP) 2003-09-04 US disclosed
EP-1295875-A1 HETEROCYCLIC COMPOUNDS Nippon Shinyaku Co., Ltd. (JP) 2003-03-26 EP disclosed
EP-0483667-B1 Cyclic imino derivatives, process for their preparation and drugs containing them THOMAE GMBH DR K (DE) 1998-02-04 EP disclosed
US-5591769-A PYRROLIDINE DERIVATIVES; ANTICOAGULANTS KARL THOMAE GMBH (DE) 1997-01-07 US disclosed
US-5541343-A ANTIAGGLOMERANTS FOR CELLS OR ANTICOAGULANTS KARL THOMAE GMBH (DE) 1996-07-30 US disclosed
EP-0483667-A2 Cyclic imino derivatives, process for their preparation and drugs containing them Dr. Karl Thomae GmbH (DE) 1992-05-06 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 (5 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-20050009785-A1 Heterocyclic compounds LIPC, GPR119, APOB CYP2A6 1209/4885HTR2A 1271/4885CYP1A2 646/4885
US-20050009892-A1 Heterocyclic compounds GPR119, LIPC, LIPE CYP2A6 1218/4885HTR2A 950/4885CYP1A2 629/4885
US-20160039751-A1 NOVEL HYDROXAMIC ACID DERIVATIVE OR SALT THEREOF H1-0, H1-2, HDAC1 CYP2A6 594/4885HTR2A 3040/4885CYP1A2 1183/4885
US-20040162325-A1 Heterocyclic compounds LIPE, GPR119, LIPC CYP2A6 1217/4885HTR2A 1263/4885CYP1A2 697/4885
US-20030166697-A1 Heterocyclic compounds LIPE, GPR119, LIPC CYP2A6 1217/4885HTR2A 1263/4885CYP1A2 697/4885

“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.