SCHEMBL829421

SCHEMBL829421

O=C(NCC1CCCCC1)Oc1ccc2cc(Br)ccc2c1Br

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NCEH1 Q6PIU2 9/20 0.53
KMT2A Q03164 3/20 0.46
MEN1 O00255 1/20 0.46
RXFP1 Q9HBX9 4/20 0.46
ALDH1A1 P00352 1/20 0.42
LMNA P02545 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL829484 0.86 NCEH1 (0.62) NCEH1RXFP1SMN1; SMN2
SCHEMBL829420 0.76 NCEH1 (0.67) NCEH1KMT2ARXFP1LMNASMN1; SMN2
SCHEMBL830131 0.71 SMN1; SMN2 (0.72) NCEH1KMT2AMEN1RXFP1ALDH1A1
SCHEMBL4190698 0.69 ALDH1A1 (0.55) KMT2AMEN1ALDH1A1LMNASMN1; SMN2
SCHEMBL19712947 0.69 NCEH1 (0.48) NCEH1KMT2ARXFP1LMNASMN1; SMN2
SCHEMBL14470481 0.69 EPHX1 (0.65) ALDH1A1LMNASMN1; SMN2
SCHEMBL9461062 0.67 EPHX1 (0.51) KMT2AMEN1ALDH1A1LMNASMN1; SMN2
SCHEMBL8392988 0.67 ALDH1A1 (0.64) KMT2AALDH1A1LMNASMN1; SMN2
SCHEMBL8395670 0.67 ALDH1A1 (0.64) KMT2AALDH1A1LMNASMN1; SMN2
SCHEMBL21089019 0.66 ALDH1A1 (0.46) KMT2AMEN1ALDH1A1LMNASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8143257-B2 inhibiting angiogenesis; cancer, diabetic retinopathy, rheumatoid arthritis, psoriasis, atherosclerosis, obesity, chronic inflammation or exudative macular degeneration; 4-(Hydroxy-diphenyl-methyl)-piperidine-1-carboxylic acid 1-bromo-naphthalen-2-yl ester PTC THERAPEUTICS, INC. (US) 2012-03-27 US disclosed
US-8143257-B2 inhibiting angiogenesis; cancer, diabetic retinopathy, rheumatoid arthritis, psoriasis, atherosclerosis, obesity, chronic inflammation or exudative macular degeneration; 4-(Hydroxy-diphenyl-methyl)-piperidine-1-carboxylic acid 1-bromo-naphthalen-2-yl ester PTC THERAPEUTICS, INC. (US) 2012-03-27 US disclosed
US-8143257-B2 inhibiting angiogenesis; cancer, diabetic retinopathy, rheumatoid arthritis, psoriasis, atherosclerosis, obesity, chronic inflammation or exudative macular degeneration; 4-(Hydroxy-diphenyl-methyl)-piperidine-1-carboxylic acid 1-bromo-naphthalen-2-yl ester PTC THERAPEUTICS, INC. (US) 2012-03-27 US disclosed
US-20080261956-A1 Substituted Phenols as Active Agents Inhibiting Vegf Production PTC THERAPEUTICS, INC. 2008-10-23 US disclosed
US-20080261956-A1 Substituted Phenols as Active Agents Inhibiting Vegf Production PTC THERAPEUTICS, INC. 2008-10-23 US disclosed
US-20080261956-A1 Substituted Phenols as Active Agents Inhibiting Vegf Production PTC THERAPEUTICS, INC. 2008-10-23 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 (1 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-20080261956-A1 Substituted Phenols as Active Agents Inhibiting Vegf Production VEGFA, FLT4, FLT1 NCEH1 3211/4885KMT2A 3045/4885MEN1 4723/4885

“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.