SCHEMBL15044396

SCHEMBL15044396

Nc1ccc(Oc2ccc(F)cn2)cc1

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.80
MEN1 O00255 5/20 0.80
KMT2A Q03164 5/20 0.80
ALDH1A1 P00352 3/20 0.54
POLB P06746 2/20 0.54
L3MBTL1 Q9Y468 2/20 0.54
RAB9A P51151 1/20 0.54
HSPB1 P04792 1/20 0.51
CYP3A4 P08684 1/20 0.46
TSHR P16473 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
BRCA1 P38398 1/20 0.45
HBB P68871 1/20 0.45
HSD17B10 Q99714 1/20 0.45
MAOB P27338 3/20 0.44
APAF1 O14727 1/20 0.44
HTT P42858 1/20 0.44
KEAP1 Q14145 1/20 0.41
MAOA P21397 2/20 0.41
FPR2 P25090 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
SCHEMBL30466074 0.89 KDM4E (1.00) KDM4EMEN1KMT2AALDH1A1POLB
SCHEMBL2721244 0.89 KDM4E (1.00) KDM4EMEN1KMT2AALDH1A1POLB
SCHEMBL29349901 0.84 KDM4E (0.90) KDM4EMEN1KMT2AALDH1A1POLB
SCHEMBL22529971 0.84 KDM4E (0.90) KDM4EMEN1KMT2AALDH1A1POLB
SCHEMBL20931746 0.84 KDM4E (0.79) KDM4EMEN1KMT2AALDH1A1POLB
SCHEMBL29078057 0.82 MEN1 (0.60) KDM4EMEN1KMT2AALDH1A1POLB
SCHEMBL29457388 0.82 MEN1 (0.60) KDM4EMEN1KMT2AALDH1A1POLB
SCHEMBL15384990 0.81 MEN1 (0.59) KDM4EMEN1KMT2AALDH1A1POLB
SCHEMBL16838787 0.81 MEN1 (0.59) KDM4EMEN1KMT2AALDH1A1POLB
SCHEMBL29244909 0.81 MEN1 (0.58) KDM4EMEN1KMT2AALDH1A1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12630525-B2 Triazinylmethylcycloalkylcarboxylic acid derivative, and pharmaceutical composition and use thereof SHANGHAI HAIYAN PHARMACEUTICAL TECHNOLOGY CO., LTD. (CN) 2026-05-19 US disclosed
WO-2024114663-A9 CRYSTAL FORM OF TRIAZINYL METHYL CYCLOALKYL CARBOXYLIC ACID DERIVATIVE AND USE THEREOF 上海海雁医药科技有限公司 2024-07-18 WO disclosed
WO-2024114663-A1 CRYSTAL FORM OF TRIAZINYL METHYL CYCLOALKYL CARBOXYLIC ACID DERIVATIVE AND USE THEREOF 上海海雁医药科技有限公司 2024-06-06 WO disclosed
EP-4349816-A1 TRIAZINYLMETHYLCYCLOALKYLCARBOXYLIC ACID DERIVATIVE, AND PHARMACEUTICAL COMPOSITION AND USE THEREOF Shanghai Haiyan Pharmaceutical Technology Co., Ltd. (CN) 2024-04-10 EP disclosed
CN-117425643-A Triazinylmethyl cycloalkyl carboxylic acid derivatives, pharmaceutical compositions and uses thereof 上海海雁医药科技有限公司 2024-01-19 CN disclosed
WO-2022253270-A1 TRIAZINYLMETHYLCYCLOALKYLCARBOXYLIC ACID DERIVATIVE, AND PHARMACEUTICAL COMPOSITION AND USE THEREOF 上海海雁医药科技有限公司 2022-12-08 WO disclosed
WO-2022253270-A1 TRIAZINYLMETHYLCYCLOALKYLCARBOXYLIC ACID DERIVATIVE, AND PHARMACEUTICAL COMPOSITION AND USE THEREOF 上海海雁医药科技有限公司 2022-12-08 WO disclosed
US-20170298058-A1 HETEROCYCLIC RING AND CARBOCYCLIC DERIVATIVE SHIONOGI & CO (JP) 2017-10-19 US disclosed
US-9550763-B2 Heterocyclic ring and carbocyclic derivative SHIONOGI & CO., LTD. (JP) 2017-01-24 US disclosed
US-20160024072-A1 Heterocyclic Ring and Carbocyclic Derivative SHIONOGI & CO., LTD. (JP) 2016-01-28 US disclosed
WO-2013089212-A1 SUBSTITUTED TRIAZINE DERIVATIVE AND PHARMACEUTICAL COMPOSITION CONTAINING SAME 塩野義製薬株式会社 (JP) 2013-06-20 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-20170298058-A1 HETEROCYCLIC RING AND CARBOCYCLIC DERIVATIVE P2RX3, P2RX7, P2RX2 KDM4E 3118/4885MEN1 4224/4885KMT2A 2771/4885
US-20160024072-A1 Heterocyclic Ring and Carbocyclic Derivative P2RX3, P2RX7, P2RX2 KDM4E 3118/4885MEN1 4224/4885KMT2A 2771/4885
US-12630525-B2 Triazinylmethylcycloalkylcarboxylic acid derivative, and pharmaceutical composition and use thereof P2RX3, P2RX1, P2RX2 KDM4E 4577/4885MEN1 4087/4885KMT2A 4282/4885

“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.