SCHEMBL18930737

SCHEMBL18930737

N#Cc1ccc(C[C@@H](N)CCO)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 2/20 0.47
DPP4 P27487 4/20 0.46
FAP Q12884 2/20 0.44
DPP8 Q6V1X1 2/20 0.44
DPP9 Q86TI2 2/20 0.44
DPP7 Q9UHL4 2/20 0.44
CYP2A6 P11509 1/20 0.42
IDO1 P14902 2/20 0.42
SLC6A4 P31645 1/20 0.38
MMP12 P39900 1/20 0.38
MMP13 P45452 1/20 0.38
EPHX1 P07099 1/20 0.38
CA12 O43570 1/20 0.38
CA2 P00918 1/20 0.38
CA3 P07451 1/20 0.38
CA6 P23280 1/20 0.38
CA9 Q16790 1/20 0.38
CA14 Q9ULX7 1/20 0.38
GSK3B P49841 1/20 0.37
SCN10A Q9Y5Y9 1/20 0.37

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
SCHEMBL14860539 0.87 LOXL2 (0.52) LOXL2DPP4FAPDPP8DPP9
SCHEMBL20397577 0.87 LOXL2 (0.52) LOXL2DPP4FAPDPP8DPP9
SCHEMBL18930595 0.87 LOXL2 (0.52) LOXL2DPP4FAPDPP8DPP9
Hydrochloric Acid SCHEMBL18920607 0.85 LOXL2 (0.50) LOXL2DPP4FAPDPP8DPP9
SCHEMBL30762158 0.79 LOXL2 (0.57) LOXL2DPP4FAPDPP8DPP9
SCHEMBL27714562 0.79 TSHR (0.49) LOXL2DPP4FAPDPP8DPP9
SCHEMBL18930741 0.79 DPP4 (0.41) LOXL2DPP4FAPDPP8DPP9
SCHEMBL5728985 0.79 CYP2A6 (0.47) LOXL2DPP4FAPDPP8DPP9
Hydrochloric Acid SCHEMBL21144815 0.78 DPP4 (0.41) LOXL2DPP4FAPDPP8DPP9
Hydrochloric Acid SCHEMBL21144818 0.78 DPP4 (0.41) LOXL2DPP4FAPDPP8DPP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10654818-B2 Furane derivatives as inhibitors of ATAD2 BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2020-05-19 US disclosed
US-10654818-B2 Furane derivatives as inhibitors of ATAD2 BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2020-05-19 US disclosed
EP-3383865-B1 FURANE DERIVATIVES AS INHIBITORS OF ATAD2 Bayer Pharma AG (DE) 2020-01-29 EP disclosed
EP-3383865-B1 FURANE DERIVATIVES AS INHIBITORS OF ATAD2 Bayer Pharma AG (DE) 2020-01-29 EP disclosed
US-20190218196-A1 FURANE DERIVATIVES AS INHIBITORS OF ATAD2 BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2019-07-18 US disclosed
US-20190218196-A1 FURANE DERIVATIVES AS INHIBITORS OF ATAD2 BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2019-07-18 US disclosed
WO-2017093272-A1 FURANE DERIVATIVES AS INHIBITORS OF ATAD2 BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2017-06-08 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 (2 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-20190218196-A1 FURANE DERIVATIVES AS INHIBITORS OF ATAD2 ATAD2, ATAD2B, TAF1L LOXL2 3917/4885DPP4 3896/4885FAP 4385/4885
US-10654818-B2 Furane derivatives as inhibitors of ATAD2 ATAD2, ATAD2B, TAF1L LOXL2 3917/4885DPP4 3896/4885FAP 4385/4885

“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.