SCHEMBL12973530

SCHEMBL12973530

Nc1ccc(NC(=O)Nc2ccc(Cl)cc2)cc1

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.79
RAB9A P51151 3/20 0.79
MEN1 O00255 7/20 0.63
KMT2A Q03164 7/20 0.63
CA12 O43570 4/20 0.62
CA1 P00915 4/20 0.62
CA2 P00918 4/20 0.62
CA9 Q16790 4/20 0.62
ALDH1A1 P00352 1/20 0.62
NPC1 O15118 3/20 0.61
HTT P42858 3/20 0.61
LMNA P02545 3/20 0.61
NLRP3 Q96P20 2/20 0.61
SMN1; SMN2 Q16637 1/20 0.61
NLRP1 Q9C000 1/20 0.61
EPHX1 P07099 1/20 0.61
ADORA3 P0DMS8 1/20 0.61
CHRM1 P11229 1/20 0.61
SLC6A2 P23975 1/20 0.61
PDE4A P27815 1/20 0.61

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
SCHEMBL8772924 0.89 RAB9A (1.00) MAPTRAB9AMEN1KMT2ACA12
SCHEMBL11048619 0.89 MEN1 (0.76) MAPTRAB9AMEN1KMT2ACA12
SCHEMBL4741253 0.89 MEN1 (0.76) MAPTRAB9AMEN1KMT2ACA12
SCHEMBL7643264 0.86 MAPT (0.70) MAPTRAB9AMEN1KMT2ACA12
SCHEMBL678618 0.82 KMT2A (0.81) MAPTRAB9AMEN1KMT2ACA12
SCHEMBL684089 0.82 KMT2A (0.81) MAPTRAB9AMEN1KMT2ACA12
SCHEMBL12973528 0.81 EPHX1 (0.79) MAPTRAB9AMEN1KMT2ACA12
SCHEMBL4105004 0.81 CNR1 (0.74) MAPTRAB9AMEN1KMT2AALDH1A1
SCHEMBL5650525 0.81 MAOA (0.67) MAPTRAB9AMEN1KMT2ACA12
SCHEMBL546369 0.81 RAB9A (0.83) MAPTRAB9AMEN1KMT2ACA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11390591-B2 2,4,6-trisubstituted s-triazine compound, preparation method therefor, and use thereof ALUDA PHARMACEUTICALS, INC. (US) 2022-07-19 US disclosed
EP-3456712-B1 NOVEL 2,4,6-TRISUBSTITUTED S-TRIAZINE COMPOUND, PREPARATION METHOD THEREFOR, AND USE THEREOF NANJING SHIQI PHARMACEUTICAL CO LTD (CN) 2022-04-20 EP disclosed
CN-109311825-B 2,4, 6-trisubstituted s-triazine compound and preparation method and application thereof 南京世其医药科技有限公司 2022-03-22 CN disclosed
US-20200190042-A1 NOVEL 2,4,6-TRISUBSTITUTED S-TRIAZINE COMPOUND, PREPARATION METHOD THEREFOR, AND USE THEREOF ALUDA PHARMACEUTICALS, INC. 2020-06-18 US disclosed
US-10611736-B2 2,4,6-trisubstituted s-triazine compound, preparation method therefor, and use thereof ALUDA PHARMACEUTICALS, INC. (US) 2020-04-07 US disclosed
US-20190144399-A1 NOVEL 2,4,6-TRISUBSTITUTED S-TRIAZINE COMPOUND, PREPARATION METHOD THEREFOR, AND USE THEREOF NANJING SHIQI PHARMACEUTICAL CO. LTD. (CN) 2019-05-16 US disclosed
EP-3456712-A1 NOVEL 2,4,6-TRISUBSTITUTED S-TRIAZINE COMPOUND, PREPARATION METHOD THEREFOR, AND USE THEREOF Nanjing Shiqi Pharmaceutical Co. Ltd. (CN) 2019-03-20 EP disclosed
CN-109311825-A Novel 2,4,6- tri- replaces s-triazine and its preparation method and application 南京世其医药科技有限公司 2019-02-05 CN disclosed
WO-2010144522-A1 UREIDOPHENYL SUBSTITUTED TRIAZINE DERIVATIVES AND THEIR THERAPEUTICAL APPLICATIONS ABRAXIS BIOSCIENCE, LLC (US) 2010-12-16 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 (4 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-11390591-B2 2,4,6-trisubstituted s-triazine compound, preparation method therefor, and use thereof VIM, HASPIN, WASF2 MAPT 1535/4885RAB9A 2349/4885MEN1 1380/4885
US-20190144399-A1 NOVEL 2,4,6-TRISUBSTITUTED S-TRIAZINE COMPOUND, PREPARATION METHOD THEREFOR, AND USE THEREOF VIM, HASPIN, WASF2 MAPT 1941/4885RAB9A 2149/4885MEN1 1503/4885
US-10611736-B2 2,4,6-trisubstituted s-triazine compound, preparation method therefor, and use thereof VIM, HASPIN, WASF2 MAPT 1535/4885RAB9A 2349/4885MEN1 1380/4885
US-20200190042-A1 NOVEL 2,4,6-TRISUBSTITUTED S-TRIAZINE COMPOUND, PREPARATION METHOD THEREFOR, AND USE THEREOF VIM, HASPIN, WASF2 MAPT 1941/4885RAB9A 2149/4885MEN1 1503/4885

“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.