SCHEMBL2380876

SCHEMBL2380876

Nc1cc(Br)cc2cc[nH]c12

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AHR P35869 3/20 0.45
CYP2A6 P11509 1/20 0.45
NR4A2 P43354 1/20 0.45
PIM3 Q86V86 1/20 0.38
KDM4E B2RXH2 1/20 0.34
MEN1 O00255 1/20 0.34
ALDH1A1 P00352 1/20 0.34
MAPT P10636 1/20 0.34
KMT2A Q03164 1/20 0.34
IKBKB O14920 4/20 0.33
CHUK O15111 4/20 0.33
CSNK2A1 P68400 1/20 0.33
IDO1 P14902 1/20 0.32
TDO2 P48775 1/20 0.32
JAK2 O60674 1/20 0.32
RPS6KA3 P51812 1/20 0.32
MELK Q14680 1/20 0.32
STK24 Q9Y6E0 1/20 0.32
ALOX5AP P20292 1/20 0.32
FEN1 P39748 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
SCHEMBL8995163 0.78 AHR (0.48) AHRCYP2A6NR4A2PIM3IKBKB
SCHEMBL16815127 0.78 IKBKB (0.35) AHRCYP2A6NR4A2IKBKBCHUK
SCHEMBL26389475 0.77 AHR (0.47) AHRCYP2A6NR4A2PIM3IKBKB
SCHEMBL15388774 0.77 AHR (0.47) AHRALDH1A1IKBKBCHUKJAK2
SCHEMBL3584001 0.75 AHR (0.45) AHRCYP2A6NR4A2PIM3IKBKB
SCHEMBL28783304 0.75 AHR (0.45) AHRCYP2A6NR4A2PIM3IKBKB
SCHEMBL564695 0.75 AHR (0.50) AHRCYP2A6NR4A2PIM3IKBKB
SCHEMBL120501 0.75 AHR (0.45) AHRCYP2A6NR4A2PIM3CSNK2A1
SCHEMBL30391792 0.75 AHR (0.45) AHRCYP2A6NR4A2PIM3CSNK2A1
SCHEMBL15934119 0.75 TDP1 (0.38) AHRCYP2A6KDM4EALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4613752-A1 POLYCYCLIC POLY(ADP-RIBOSE) POLYMERASE SELECTIVE INHIBITOR Xuanzhu Biopharmaceutical Co., Ltd. (CN) 2025-09-10 EP disclosed
US-20250270224-A1 POLYCYCLIC POLY(ADP-RIBOSE) POLYMERASE SELECTIVE INHIBITOR Xuanzhu Biopharmaceutical Co., Ltd. (CN) 2025-08-28 US disclosed
EP-3492474-B1 INTERMEDIATES USED IN THE PRODUCTION OF DIACYLGLYCEROL ACYLTRANSFERASE INHIBITORS GLAXOSMITHKLINE LLC (US) 2021-08-11 EP disclosed
EP-3492474-B1 INTERMEDIATES USED IN THE PRODUCTION OF DIACYLGLYCEROL ACYLTRANSFERASE INHIBITORS GLAXOSMITHKLINE LLC (US) 2021-08-11 EP disclosed
EP-2968272-B1 USE OF INDOLE COMPOUNDS FOR FAT REDUCTION AND SKIN AND SOFT TISSUE TIGHTENING ALEVERE MEDICAL CORP (US) 2021-06-16 EP disclosed
EP-2968272-B1 USE OF INDOLE COMPOUNDS FOR FAT REDUCTION AND SKIN AND SOFT TISSUE TIGHTENING ALEVERE MEDICAL CORP (US) 2021-06-16 EP disclosed
US-10653670-B2 Use of indole compounds for fat reduction and skin and soft tissue tightening ALEVERE MEDICAL CORPORATION (US) 2020-05-19 US disclosed
US-10653670-B2 Use of indole compounds for fat reduction and skin and soft tissue tightening ALEVERE MEDICAL CORPORATION (US) 2020-05-19 US disclosed
EP-3031928-B1 QUICK METHOD FOR DETECTING ENZYMES AND MICRO-ORGANISMS BIO RAD INNOVATIONS (FR) 2019-11-20 EP disclosed
US-20190290613-A1 USE OF INDOLE COMPOUNDS FOR FAT REDUCTION AND SKIN AND SOFT TISSUE TIGHTENING ALEVERE MEDICAL CORPORATION 2019-09-26 US disclosed
EP-2542688-A1 QUICK METHOD FOR DETECTING ENZYMES AND MICRO-ORGANISMS Bio-Rad Innovations (FR) 2013-01-09 EP disclosed
WO-2011107703-A1 QUICK METHOD FOR DETECTING ENZYMES AND MICRO-ORGANISMS BIO-RAD PASTEUR (FR) 2011-09-09 WO disclosed
US-20100179123-A1 THIENOPYRIMIDINES USEFUL AS AURORA KINASE INHIBITORS SUNESIS PHARMACEUTICALS, INC. (US) 2010-07-15 US disclosed
US-7601725-B2 Thienopyrimidines useful as Aurora kinase inhibitors SUNESIS PHARMACEUTICALS, INC. (US) 2009-10-13 US disclosed
US-7601725-B2 Thienopyrimidines useful as Aurora kinase inhibitors SUNESIS PHARMACEUTICALS, INC. (US) 2009-10-13 US disclosed
US-20070099991-A1 SELECTIVE RXR LIGANDS HAFFNER CURT D 2007-05-03 US disclosed
US-7173134-B2 Selective RXR ligands SMITHKLINE BEECHAM CORPORATION (US) 2007-02-06 US disclosed
US-20040198980-A1 Selective rxr ligands SMITHKLINE BEECHAM CORPORATION 2004-10-07 US disclosed
EP-1430042-A2 BICYCLIC HETEROCYCLES AS RXR LIGANDS SmithKline Beecham Corporation (US) 2004-06-23 EP disclosed
WO-2003027090-A2 BICYCLIC HETEROCYCLES AS RXR LIGANDS SMITHKLINE BEECHAM CORPORATION (US) 2003-04-03 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 (6 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-20040198980-A1 Selective rxr ligands RXRA, RXRB, RXRG AHR 284/4885CYP2A6 669/4885NR4A2 17/4885
US-20250270224-A1 POLYCYCLIC POLY(ADP-RIBOSE) POLYMERASE SELECTIVE INHIBITOR PARP1, PARP11, PARP2 AHR 2665/4885CYP2A6 2352/4885NR4A2 4708/4885
US-20190290613-A1 USE OF INDOLE COMPOUNDS FOR FAT REDUCTION AND SKIN AND SOFT TISSUE TIGHTENING IDO1, FABP4, IDO2 AHR 68/4885CYP2A6 2354/4885NR4A2 3975/4885
US-20100179123-A1 THIENOPYRIMIDINES USEFUL AS AURORA KINASE INHIBITORS AURKA, AURKB, AURKC AHR 2895/4885CYP2A6 3556/4885NR4A2 2678/4885
US-20070099991-A1 SELECTIVE RXR LIGANDS RXRB, RXRA, RXRG AHR 255/4885CYP2A6 775/4885NR4A2 20/4885
US-10653670-B2 Use of indole compounds for fat reduction and skin and soft tissue tightening IDO1, FABP4, IDO2 AHR 68/4885CYP2A6 2354/4885NR4A2 3975/4885

“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.