SCHEMBL830131

SCHEMBL830131

O=C(Oc1ccc2cc(Br)ccc2c1Br)N1CCCCC1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 8/20 0.72
RAB9A P51151 7/20 0.72
NPC1 O15118 5/20 0.72
NCEH1 Q6PIU2 4/20 0.72
HPGD P15428 4/20 0.72
HTT P42858 2/20 0.72
CYP1A2 P05177 1/20 0.72
CYP3A4 P08684 1/20 0.72
CYP2C9 P11712 1/20 0.72
CYP2C19 P33261 1/20 0.72
LMNA P02545 5/20 0.65
MAPT P10636 5/20 0.65
TDP1 Q9NUW8 3/20 0.65
L3MBTL1 Q9Y468 2/20 0.65
ATM Q13315 1/20 0.65
KMT2A Q03164 3/20 0.53
RXFP1 Q9HBX9 2/20 0.53
TP53 P04637 2/20 0.51
CASP3 P42574 1/20 0.51
SENP8 Q96LD8 1/20 0.51

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
SCHEMBL829714 0.87 KMT2A (0.69) SMN1; SMN2RAB9ANPC1NCEH1HPGD
SCHEMBL830062 0.84 RAB9A (1.00) SMN1; SMN2RAB9ANPC1NCEH1HPGD
SCHEMBL829826 0.79 SMN1; SMN2 (1.00) SMN1; SMN2RAB9ANPC1NCEH1HPGD
SCHEMBL28788178 0.78 RECQL (0.63) SMN1; SMN2RAB9ANPC1NCEH1HPGD
SCHEMBL27814987 0.78 ALDH1A1 (0.65) SMN1; SMN2RAB9ANPC1NCEH1HPGD
SCHEMBL27793337 0.78 SMN1; SMN2 (0.59) SMN1; SMN2RAB9ANPC1NCEH1HPGD
SCHEMBL31264704 0.76 SMN1; SMN2 (0.57) SMN1; SMN2RAB9ANPC1NCEH1HPGD
SCHEMBL25249657 0.75 SMN1; SMN2 (0.59) SMN1; SMN2RAB9ANPC1NCEH1HPGD
SCHEMBL31264745 0.73 SMN1; SMN2 (0.54) SMN1; SMN2RAB9ANPC1NCEH1HPGD
SCHEMBL829420 0.72 NCEH1 (0.67) SMN1; SMN2RAB9ANPC1NCEH1LMNA

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 SMN1; SMN2 4842/4885RAB9A 3160/4885NPC1 3721/4885

“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.