SCHEMBL896090

SCHEMBL896090

COc1ccc(F)cc1[C@@H](C)N

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 2/20 0.49
ADRA2A P08913 2/20 0.49
ADRA1A P35348 2/20 0.49
MEN1 O00255 1/20 0.47
MAPK1 P28482 1/20 0.47
BLM P54132 1/20 0.47
KMT2A Q03164 1/20 0.47
ALK Q9UM73 2/20 0.41
NFE2L2 Q16236 1/20 0.41
HTR2A P28223 3/20 0.40
HTR2C P28335 1/20 0.40
KDM4E B2RXH2 2/20 0.40
SLC6A4 P31645 1/20 0.39
KCNH2 Q12809 1/20 0.39

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
SCHEMBL29429683 1.00 CYP2D6 (0.49) CYP2D6ADRA2AADRA1AMEN1MAPK1
SCHEMBL669891 1.00 CYP2D6 (0.49) CYP2D6ADRA2AADRA1AMEN1MAPK1
SCHEMBL895659 1.00 CYP2D6 (0.49) CYP2D6ADRA2AADRA1AMEN1MAPK1
SCHEMBL30166162 0.85 CYP2D6 (0.41) CYP2D6ADRA2AADRA1AMEN1MAPK1
SCHEMBL3725877 0.85 CYP2D6 (0.41) CYP2D6ADRA2AADRA1AMEN1MAPK1
SCHEMBL25180793 0.85 CYP2D6 (0.41) CYP2D6ADRA2AADRA1AMEN1MAPK1
SCHEMBL3702590 0.85 CYP2D6 (0.41) CYP2D6ADRA2AADRA1AMEN1MAPK1
SCHEMBL30949362 0.85 CYP2D6 (0.41) CYP2D6ADRA2AADRA1AMEN1MAPK1
SCHEMBL8119851 0.84 NFE2L2 (0.43) CYP2D6ADRA2AADRA1AALKNFE2L2
SCHEMBL1161748 0.83 IDO1 (0.41) CYP2D6ADRA2AADRA1AMEN1MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260028352-A1 MACROCYCLIC IMIDAZO [1,2-B] PYRIDAZINE DERIVATIVE, PREPARATION METHOD THEREFOR, AND USE THEREOF SUZHOU LANGRUI BIOPHARMACEUTICAL CO LTD (CN) 2026-01-29 US disclosed
EP-4585598-A1 MACROCYCLIC IMIDAZO[1,2-B]PYRIDAZINE DERIVATIVE, PREPARATION METHOD THEREFOR, AND USE THEREOF Suzhou Langrui Biopharmaceutical Co., Ltd. (CN) 2025-07-16 EP disclosed
CN-117659020-A Imidazo [1,2-b ] pyridazine derivative, and preparation method and application thereof 苏州朗睿生物医药有限公司 2024-03-08 CN disclosed
CN-117659043-A Macrocyclic imidazo [1,2-b ] pyridazine derivative and preparation method and application thereof 苏州朗睿生物医药有限公司 2024-03-08 CN disclosed
CN-117624166-A Triazole derivative and preparation method and application thereof 苏州朗睿生物医药有限公司 2024-03-01 CN disclosed
US-20240025908-A1 COMPOUND USED AS KINASE INHIBITOR AND USE THEREOF TYK MEDICINES, INC. (CN) 2024-01-25 US disclosed
EP-3967696-A1 COMPOUND USED AS KINASE INHIBITOR AND APPLICATION THEREOF TYK Medicines Inc. (CN) 2022-03-16 EP disclosed
WO-2020224626-A1 COMPOUND USED AS KINASE INHIBITOR AND APPLICATION THEREOF 浙江同源康医药股份有限公司 2020-11-12 WO disclosed
US-9879293-B2 Enzymatic transamination of cyclopamine analogs INFINITY PHARMACEUTICALS, INC. (US) 2018-01-30 US disclosed
US-20160177354-A1 ENZYMATIC TRANSAMINATION OF CYCLOPAMINE ANALOGS SAFC, INC. 2016-06-23 US disclosed
EP-2462115-B1 ENZYMATIC TRANSAMINATION OF CYCLOPAMINE ANALOGS INFINITY PHARMACEUTICALS INC (US) 2016-01-06 EP disclosed
US-20140371456-A1 Enzymatic Transamination of Cyclopamine Analogs ROYALTY SECURITY, LLC 2014-12-18 US disclosed
US-8703448-B2 Enzymatic transamination of cyclopamine analogs INFINITY PHARMACEUTICALS, INC. (US) 2014-04-22 US disclosed
US-20120083607-A1 Enzymatic Transamination of Cyclopamine Analogs INFINITY PHARMACEUTICALS, INC. (US) 2012-04-05 US 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-20240025908-A1 COMPOUND USED AS KINASE INHIBITOR AND USE THEREOF ROS1, ALK, RET CYP2D6 1637/4885ADRA2A 2916/4885ADRA1A 1047/4885
US-20120083607-A1 Enzymatic Transamination of Cyclopamine Analogs TKT, TALDO1, BCHE CYP2D6 554/4885ADRA2A 4133/4885ADRA1A 3775/4885
US-20140371456-A1 Enzymatic Transamination of Cyclopamine Analogs TKT, TALDO1, BCHE CYP2D6 554/4885ADRA2A 4133/4885ADRA1A 3775/4885
US-20260028352-A1 MACROCYCLIC IMIDAZO [1,2-B] PYRIDAZINE DERIVATIVE, PREPARATION METHOD THEREFOR, AND USE THEREOF WEE2, WEE1, ROR1 CYP2D6 203/4885ADRA2A 1125/4885ADRA1A 458/4885

“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.