SCHEMBL1664232

SCHEMBL1664232

Nc1ccc(C(=O)c2ccc(C(=O)NC3CC3)cc2)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMYD3 Q9H7B4 5/20 0.59
RAB9A P51151 5/20 0.59
NPC1 O15118 4/20 0.59
KMT2A Q03164 3/20 0.59
SMN1; SMN2 Q16637 2/20 0.59
MEN1 O00255 2/20 0.59
MAPT P10636 1/20 0.54
CYP1A2 P05177 1/20 0.53
HPGD P15428 1/20 0.53
CYP2C19 P33261 1/20 0.53
DDB1 Q16531 1/20 0.51
CRBN Q96SW2 1/20 0.51
IKZF3 Q9UKT9 1/20 0.51
MAOA P21397 1/20 0.50
MAOB P27338 1/20 0.50
ST14 Q9Y5Y6 1/20 0.50
LMNA P02545 2/20 0.49
POLB P06746 1/20 0.48
PKM P14618 1/20 0.48
APEX1 P27695 1/20 0.48

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
SCHEMBL30583805 0.96 RAB9A (0.62) SMYD3RAB9ANPC1KMT2ASMN1; SMN2
SCHEMBL3442327 0.96 RAB9A (0.62) SMYD3RAB9ANPC1KMT2ASMN1; SMN2
SCHEMBL3633642 0.91 RAB9A (0.72) SMYD3RAB9ANPC1KMT2ASMN1; SMN2
SCHEMBL12156531 0.89 RAB9A (0.62) SMYD3RAB9ANPC1KMT2ASMN1; SMN2
SCHEMBL12156569 0.89 RAB9A (0.67) SMYD3RAB9ANPC1KMT2ASMN1; SMN2
SCHEMBL14117659 0.88 NPC1 (0.59) SMYD3RAB9ANPC1KMT2ASMN1; SMN2
SCHEMBL3546724 0.87 RAB9A (0.70) RAB9ANPC1KMT2ASMN1; SMN2CYP1A2
SCHEMBL13575468 0.84 KHK (0.54) SMYD3RAB9ANPC1KMT2ASMN1; SMN2
SCHEMBL1560664 0.84 KDM1A (0.53) SMYD3RAB9ANPC1KMT2ASMN1; SMN2
SCHEMBL14117679 0.84 SMYD3 (0.51) SMYD3RAB9ANPC1KMT2ASMN1; 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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9622991-B2 Hematopoietic growth factor mimetic small molecule compounds and their uses LIGAND PHARMACEUTICALS INC. (US) 2017-04-18 US disclosed
US-9144557-B2 Hematopoietic growth factor mimetic small molecule compounds and their uses LIGAND PHARMACEUTICALS INC. (US) 2015-09-29 US disclosed
US-20150252043-A1 HEMATOPOIETIC GROWTH FACTOR MIMETIC SMALL MOLECULE COMPOUNDS AND THEIR USES CITIBANK, N.A., AS ADMINISTRATIVE AGENT 2015-09-10 US disclosed
US-20140243324-A1 USE OF HEMATOPOIETIC GROWTH FACTOR MIMETICS LIGAND PHARMACEUTICALS INCORPORATED (US) 2014-08-28 US disclosed
EP-2642994-A2 USE OF HEMATOPOIETIC GROWTH FACTOR MIMETICS Ligand Pharmaceuticals Incorporated (US) 2013-10-02 EP disclosed
US-20120295904-A1 HEMATOPOIETIC GROWTH FACTOR MIMETIC SMALL MOLECULE COMPOUNDS AND THEIR USES LIGAND PHARMACEUTICALS INC. (US) 2012-11-22 US disclosed
EP-2488486-A1 HEMATOPOIETIC GROWTH FACTOR MIMETIC SMALL MOLECULE COMPOUNDS AND THEIR USES Ligand Pharmaceuticals Inc. (US) 2012-08-22 EP disclosed
WO-2012068406-A2 USE OF HEMATOPOIETIC GROWTH FACTOR MIMETICS LIGAND PHARMACEUTICALS INCORPORATED (US) 2012-05-24 WO disclosed
WO-2011046954-A1 HEMATOPOIETIC GROWTH FACTOR MIMETIC SMALL MOLECULE COMPOUNDS AND THEIR USES LIGAND PHARMACEUTICALS INC. (US) 2011-04-21 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 (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-20140243324-A1 USE OF HEMATOPOIETIC GROWTH FACTOR MIMETICS HGF, EPOR, MPL SMYD3 2302/4885RAB9A 4230/4885NPC1 4635/4885
US-20150252043-A1 HEMATOPOIETIC GROWTH FACTOR MIMETIC SMALL MOLECULE COMPOUNDS AND THEIR USES MPL, CSF3R, HGF SMYD3 1128/4885RAB9A 3140/4885NPC1 4555/4885
US-20120295904-A1 HEMATOPOIETIC GROWTH FACTOR MIMETIC SMALL MOLECULE COMPOUNDS AND THEIR USES MPL, CSF3R, HGF SMYD3 1128/4885RAB9A 3140/4885NPC1 4555/4885

“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.