SCHEMBL705048

SCHEMBL705048

O=C(c1ccccc1)n1nccc1O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F2 P00734 5/20 0.46
KMT2A Q03164 5/20 0.46
HPGD P15428 4/20 0.46
MGAM O43451 3/20 0.46
AMY1A P0DUB6 3/20 0.46
GAA P10253 3/20 0.46
SI P14410 3/20 0.46
MGAM2 Q2M2H8 3/20 0.46
SLC9A1 P19634 1/20 0.46
ELANE P08246 5/20 0.45
MAPT P10636 4/20 0.41
P2RX4 Q99571 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
F12 P00748 1/20 0.40
PLAU P00749 2/20 0.40
MEN1 O00255 2/20 0.40
RORC P51449 1/20 0.40
ALDH1A1 P00352 1/20 0.40

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
SCHEMBL13731712 0.71 HPGD (0.45) F2KMT2AHPGDMGAMAMY1A
Hydrochloric Acid SCHEMBL9958956 0.69 HPGD (0.44) F2KMT2AHPGDMGAMAMY1A
SCHEMBL11220245 0.69 MAPT (0.61) F2KMT2AHPGDMGAMAMY1A
SCHEMBL20448840 0.69 HPGD (0.42) F2KMT2AHPGDMGAMAMY1A
SCHEMBL11009351 0.67 ELANE (0.64) F2KMT2AHPGDMGAMAMY1A
SCHEMBL496975 0.67 ELANE (0.70) F2KMT2AHPGDMGAMAMY1A
SCHEMBL2578137 0.67 F2 (0.46) F2KMT2AHPGDMGAMAMY1A
SCHEMBL11285194 0.67 ELANE (0.44) F2KMT2AHPGDMGAMAMY1A
SCHEMBL135362 0.67 ELANE (0.60) F2ELANEPLAUALDH1A1KLKB1
SCHEMBL5579308 0.63 POLB (0.57) GAACYP2C9CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2325176-B1 Process for the preparation of Isoxazolin-3-yl-Acylbenzenes BASF SE (DE) 2015-02-25 EP disclosed
EP-2298749-B1 Process for the preparation of Thioethers BASF SE (DE) 2014-12-24 EP disclosed
CN-101679284-B 4-(4-trifluoromethyl-3-thiobenzoyl)pyrazoles, and use thereof as herbicides BAYER CROPSCIENCE AG 2013-03-27 CN disclosed
US-8124810-B2 Preparation of isoxazolin-3-ylacylbenzenes BASF SE (DE) 2012-02-28 US disclosed
US-8049017-B2 Preparation of isoxazolin-3-ylacylbenzenes BASF SE (DE) 2011-11-01 US disclosed
US-20110152535-A1 PREPARATION OF ISOXAZOLIN-3-YLACYLBENZENES RHEINHEIMER JOACHIM 2011-06-23 US disclosed
EP-2325176-A1 Process for the preparation of isoxazolin-3-yl-acylbenzenes BASF SE (DE) 2011-05-25 EP disclosed
EP-2298749-A1 Process for the preparation of Thioethers BASF SE (DE) 2011-03-23 EP disclosed
CN-101113137-B Intermidiate for preparing 1,2-oxygen nitrogen heterocyclic-2-alkene acylbenzene and its preparation BASF AG 2010-12-29 CN disclosed
US-20100105920-A1 PREPARATION OF ISOXAZOLIN-3-YLACYLBENZENES BASF SE (DE) 2010-04-29 US disclosed
EP-1852424-A2 Method for manufacturing isoxazoline-3-yL-acyl benzoles BASF AKTIENGESELLSCHAFT (DE) 2007-11-07 EP disclosed
US-20070161800-A1 Preparation of Isoxazolin-3-Ylacylbenzene BASF SE (DE) 2007-07-12 US disclosed
EP-1077955-B1 METHOD FOR PRODUCING ISOXAZOLINE-3-YL-ACYL BENZENE BASF AG (DE) 2007-06-27 EP disclosed
CN-1255377-C Intermediate for preparing isoxazoline-3-yl acyl benzene and process for preparing intermediate BASF AG (DE) 2006-05-10 CN disclosed
CN-1757634-A Intermidiate for preparing 1,2-oxygen nitrogen heterocyclic-2-alkene acylbenzene and its preparation BASF AG (DE) 2006-04-12 CN disclosed
CN-1495158-A Intermediate for preparing isoxazoline-3-yl acyl benzene and process for preparing intermediate �����ɷ� 2004-05-12 CN disclosed
CN-1139578-C Preparation of isoxazolin-3-yl-acylbenzenes �����ɷ� 2004-02-25 CN disclosed
US-20030216580-A1 Preparation of Isoxazolin-3-Ylacylbenzene BASF SE (DE) 2003-11-20 US disclosed
US-20030018200-A1 Preparation of isoxazolin-3-ylacylbenzenes BASF SE (DE) 2003-01-23 US disclosed
CN-1300284-A Preparation of isoxazolin-3-yl-acylbenzenes BASF AG (DE) 2001-06-20 CN 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-20070161800-A1 Preparation of Isoxazolin-3-Ylacylbenzene CBR3, UQCRB, CYP4X1 F2 401/4885KMT2A 2028/4885HPGD 1339/4885
US-20110152535-A1 PREPARATION OF ISOXAZOLIN-3-YLACYLBENZENES CBR3, CYP4X1, UQCRB F2 305/4885KMT2A 2171/4885HPGD 1423/4885
US-20100105920-A1 PREPARATION OF ISOXAZOLIN-3-YLACYLBENZENES CBR3, CYP4X1, UQCRB F2 305/4885KMT2A 2171/4885HPGD 1423/4885
US-20030216580-A1 Preparation of Isoxazolin-3-Ylacylbenzene UQCRB, CYP1B1, CYP2F1 F2 639/4885KMT2A 1465/4885HPGD 2063/4885
US-20030018200-A1 Preparation of isoxazolin-3-ylacylbenzenes CYP2F1, UQCRB, CYP1B1 F2 674/4885KMT2A 1837/4885HPGD 2407/4885

“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.