SCHEMBL1765119

SCHEMBL1765119

NCc1cc(Br)cc(Br)c1

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 3/20 0.52
TAAR1 Q96RJ0 2/20 0.42
LOXL2 Q9Y4K0 5/20 0.38
HRH3 Q9Y5N1 1/20 0.38
HTR2A P28223 1/20 0.38
AGXT P21549 2/20 0.36
ABAT P80404 1/20 0.35
PNMT P11086 1/20 0.35
ENPP2 Q13822 1/20 0.35
ST14 Q9Y5Y6 1/20 0.35
TACR1 P25103 1/20 0.33
RAD52 P43351 1/20 0.32
KMT2A Q03164 1/20 0.32
RXFP1 Q9HBX9 1/20 0.32

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
SCHEMBL1872002 0.97 IDO1 (0.50) IDO1TAAR1LOXL2HRH3HTR2A
SCHEMBL11437281 0.87 IDO1 (0.43) IDO1TAAR1LOXL2HRH3HTR2A
SCHEMBL18494541 0.84 IDO1 (0.41) IDO1TAAR1LOXL2HTR2AABAT
SCHEMBL2039301 0.84 LOXL2 (0.42) IDO1TAAR1LOXL2
SCHEMBL29897365 0.84 PNMT (0.46) IDO1TAAR1LOXL2PNMT
SCHEMBL24264540 0.84 IDO1 (0.46) IDO1TAAR1AGXTABATENPP2
SCHEMBL16635217 0.84 IDO1 (0.41) IDO1TAAR1HTR2ATACR1
SCHEMBL1363469 0.84 PNMT (0.46) IDO1TAAR1LOXL2PNMT
SCHEMBL1363875 0.84 TACR1 (0.44) IDO1TAAR1LOXL2HTR2ATACR1
SCHEMBL27824736 0.84 IDO1 (0.41) IDO1TAAR1HTR2AABATENPP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12637428-B2 Isoquinoline derivatives as SIK2 inhibitors CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2026-05-26 US disclosed
US-12428397-B2 Factor XI activation inhibitors MERCK SHARP & DOHME LLC (US) 2025-09-30 US disclosed
EP-4149917-B1 FACTOR XI ACTIVATION INHIBITORS MERCK SHARP & DOHME LLC (US) 2025-07-30 EP disclosed
US-12145929-B2 Piperidine derivative and pharmaceutical composition for inhibiting autotaxin comprising same NEXTGEN BIOSCIENCE CO., LTD. (KR) 2024-11-19 US disclosed
US-20240279216-A1 NOVEL PIPERIDINE DERIVATIVE AND PHARMACEUTICAL COMPOSITION FOR INHIBITING AUTOTAXIN COMPRISING SAME NEXTGEN BIOSCIENCE CO., LTD. (KR) 2024-08-22 US disclosed
CN-118159537-A 6-Aza-quinoline derivatives and related uses 黑钻治疗公司 2024-06-07 CN disclosed
EP-4353720-A1 NOVEL PIPERIDINE DERIVATIVE AND PHARMACEUTICAL COMPOSITION FOR INHIBITING AUTOTAXIN COMPRISING SAME Nextgen Bioscience Co., Ltd. (KR) 2024-04-17 EP disclosed
CN-117396471-A Novel piperidine derivatives and pharmaceutical compositions for inhibiting autotaxin comprising the same 株式会社次代生物科学 2024-01-12 CN disclosed
WO-2023101326-A1 NOVEL COMPOUND AS AUTOTAXIN INHIBITOR AND USE THEREOF 주식회사 넥스트젠바이오사이언스 2023-06-08 WO disclosed
US-20230167085-A1 FACTOR XI ACTIVATION INHIBITORS MERCK SHARP & DOHME LLC (US) 2023-06-01 US disclosed
WO-2007002214-A2 ACYL GUANIDINES AS BETA-SECRETASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2007-01-04 WO disclosed
WO-2007002214-A2 ACYL GUANIDINES AS BETA-SECRETASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2007-01-04 WO disclosed
WO-2007002220-A2 AMINOACETAMIDE ACYL GUANIDINES AS BETA-SECRETASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2007-01-04 WO disclosed
US-20060287287-A1 Aminoacetamide acyl guanidines as beta-secretase inhibitors BRISTOL-MYERS SQUIBB COMPANY 2006-12-21 US disclosed
US-20060223830-A1 Indanyl-piperazine compounds LES LABORATOIRES SERVIER (FR) 2006-10-05 US disclosed
WO-2006103342-A2 INDANYL-PIPERAZINE DERIVATIVES, METHOD FOR PREPARING SAME AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME LES LABORATOIRES SERVIER (FR) 2006-10-05 WO disclosed
EP-1707564-A2 Indanyl-piperazine derivatives, process for their preparation and pharmaceutical compositions containing them Les Laboratoires Servier (FR) 2006-10-04 EP disclosed
CN-1840527-A Indanyl-piperazine derivatives, process for their preparation and pharmaceutical compositions containing them SERVIER LAB (FR) 2006-10-04 CN disclosed
US-6337368-B1 WATER INSOLUBLE CARRIERS WITH P-NITROBENZOIC ACID, AROMATIC AMINES, AMIDES, SULFONAMIDES AND HYDRAZIDES KANEKA CORPORATION (JP) 2002-01-08 US disclosed
EP-1008383-A1 LIPOPROTEIN ADSORBENT AND LIPOPROTEIN ADSORBER MADE WITH THE USE OF THE SAME KANEKA CORPORATION (JP) 2000-06-14 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 (7 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-20060223830-A1 Indanyl-piperazine compounds HTR4, NR4A1, NR4A3 IDO1 315/4885TAAR1 244/4885LOXL2 3963/4885
US-20240279216-A1 NOVEL PIPERIDINE DERIVATIVE AND PHARMACEUTICAL COMPOSITION FOR INHIBITING AUTOTAXIN COMPRISING SAME ENPP2, UACA, ITCH IDO1 588/4885TAAR1 2013/4885LOXL2 2033/4885
US-12637428-B2 Isoquinoline derivatives as SIK2 inhibitors SIK2, SIK1, SIK3 IDO1 325/4885TAAR1 1954/4885LOXL2 2058/4885
US-12428397-B2 Factor XI activation inhibitors F11, TFPI, F13B IDO1 3472/4885TAAR1 4676/4885LOXL2 442/4885
US-20060287287-A1 Aminoacetamide acyl guanidines as beta-secretase inhibitors APP, BACE1, BACE2 IDO1 2441/4885TAAR1 2089/4885LOXL2 4618/4885
US-20230167085-A1 FACTOR XI ACTIVATION INHIBITORS F11, TFPI, F13B IDO1 3472/4885TAAR1 4676/4885LOXL2 442/4885
US-12145929-B2 Piperidine derivative and pharmaceutical composition for inhibiting autotaxin comprising same ENPP2, UACA, ACAT2 IDO1 534/4885TAAR1 2073/4885LOXL2 1987/4885

“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.