SCHEMBL3920300

SCHEMBL3920300

COc1ccc(CN[C@H](C)c2ccccc2)cc1-c1ccc2nccn2c1

nearest known ligand 0.59

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ CASR P41180 9/20 0.59
▸ TRIM33 Q9UPN9 4/20 0.45
▸ AXL P30530 1/20 0.43
▸ FLT3 P36888 1/20 0.43
▸ MERTK Q12866 1/20 0.43
▸ LMNA P02545 1/20 0.42
▸ KMT2A Q03164 2/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ RET P07949 1/20 0.40
▸ ATP1A1 P05023 1/20 0.40
▸ ATP1B1 P05026 1/20 0.40
▸ ATP1A3 P13637 1/20 0.40
▸ ATP1B2 P14415 1/20 0.40
▸ ATP1A2 P50993 1/20 0.40
▸ ATP1B3 P54709 1/20 0.40
▸ FXYD2 P54710 1/20 0.40
▸ ATP1A4 Q13733 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
SCHEMBL3920376 0.86 TRIM33 (0.44) CASRTRIM33AXLFLT3MERTK
SCHEMBL24529200 0.81 TRIM33 (0.41) CASRTRIM33AXLFLT3MERTK
SCHEMBL24529202 0.81 TRIM33 (0.46) TRIM33AXLFLT3MERTKRET
SCHEMBL13868174 0.80 CASR (0.78) CASRLMNAKMT2AMEN1TDP1
SCHEMBL13868195 0.79 CASR (0.74) CASRLMNAKMT2AMEN1TDP1
SCHEMBL13868189 0.79 CASR (0.73) CASRLMNAKMT2AMEN1TDP1
SCHEMBL3922135 0.79 CASR (0.64) CASRLMNAKMT2AMEN1TDP1
SCHEMBL3931123 0.78 CASR (0.63) CASRLMNAKMT2AMEN1TDP1
SCHEMBL13868162 0.78 CASR (0.76) CASRLMNAKMT2AMEN1TDP1
SCHEMBL4070323 0.78 CASR (0.62) CASRLMNAKMT2AMEN1TDP1

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-7524873-B2 Substituted N-phenylmethyl ethanamines; N-((6-(methyloxy)-4'-(trifluoromethyl)-1,1'-biphenyl-3-yl)methyl)-1-(1-naphthalenyl)ethanamine; parathyroid hormone inhibitors; antisecretory agents; osteoporosis AMGEN INC. (US) 2009-04-28 — — US claimed
US-20070142381-A1 Calcium receptor modulating agents AMGEN INC. 2007-06-21 — — US claimed
US-7524873-B2 Substituted N-phenylmethyl ethanamines; N-((6-(methyloxy)-4'-(trifluoromethyl)-1,1'-biphenyl-3-yl)methyl)-1-(1-naphthalenyl)ethanamine; parathyroid hormone inhibitors; antisecretory agents; osteoporosis AMGEN INC. (US) 2009-04-28 — — US disclosed
US-7524873-B2 Substituted N-phenylmethyl ethanamines; N-((6-(methyloxy)-4'-(trifluoromethyl)-1,1'-biphenyl-3-yl)methyl)-1-(1-naphthalenyl)ethanamine; parathyroid hormone inhibitors; antisecretory agents; osteoporosis AMGEN INC. (US) 2009-04-28 — — US disclosed
US-7524873-B2 Substituted N-phenylmethyl ethanamines; N-((6-(methyloxy)-4'-(trifluoromethyl)-1,1'-biphenyl-3-yl)methyl)-1-(1-naphthalenyl)ethanamine; parathyroid hormone inhibitors; antisecretory agents; osteoporosis AMGEN INC. (US) 2009-04-28 — — US disclosed
US-20070142381-A1 Calcium receptor modulating agents AMGEN INC. 2007-06-21 — — US disclosed
US-20070142381-A1 Calcium receptor modulating agents AMGEN INC. 2007-06-21 — — US disclosed
US-20070142381-A1 Calcium receptor modulating agents AMGEN INC. 2007-06-21 — — US disclosed
US-7196102-B2 Calcium receptor modulating agents AMGEN INC. (US) 2007-03-27 — — US disclosed
US-7196102-B2 Calcium receptor modulating agents AMGEN INC. (US) 2007-03-27 — — US disclosed
US-7196102-B2 Calcium receptor modulating agents AMGEN INC. (US) 2007-03-27 — — US disclosed
US-20050143426-A1 Osteoporosis, bone disorders, or diseases associated with excessive secretion of PTH, such as hyperparathyroidism; reduce or inhibit parathyroid hormone (PTH) secretion AMGEN INC. 2005-06-30 — — US disclosed
US-6908935-B2 Calcium receptor modulating agents AMGEN INC. (US) 2005-06-21 — — US disclosed
US-20040082625-A1 Calcium receptor modulating agents AMGEN INC. 2004-04-29 — — 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 (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-20040082625-A1 Calcium receptor modulating agents PTH1R, CASR, CALCR CASR 2/4885TRIM33 3655/4885AXL 2067/4885
US-20070142381-A1 Calcium receptor modulating agents PTH1R, CASR, CALCR CASR 2/4885TRIM33 3685/4885AXL 2043/4885
US-20050143426-A1 Osteoporosis, bone disorders, or diseases associated with excessive secretion of PTH, such as hyperparathyroidism; reduce or inhibit parathyroid hormone (PTH) secretion PTH1R, PTMS, SOST CASR 24/4885TRIM33 2697/4885AXL 3741/4885

“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.

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