SCHEMBL6846686

SCHEMBL6846686

Cc1cc(NC(=O)c2cccc(CCC(=O)CC(=S)Nc3ccc(S(=O)(=O)N(C)C(c4ccccc4)c4ccccc4)cc3)c2)ccc1C(C)C

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.42
LMNA P02545 6/20 0.42
SMN1; SMN2 Q16637 3/20 0.38
ALDH1A1 P00352 3/20 0.38
ALOX12 P18054 2/20 0.38
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
TSHR P16473 1/20 0.38
HTT P42858 2/20 0.37
NAMPT P43490 2/20 0.36
GPR55 Q9Y2T6 1/20 0.36
NPSR1 Q6W5P4 2/20 0.36
CCR5 P51681 1/20 0.36
THRB P10828 1/20 0.35

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
SCHEMBL6848189 0.80 MAPT (0.38) MAPTLMNASMN1; SMN2ALDH1A1MEN1
SCHEMBL6841416 0.71 RAB9A (0.44) MAPTLMNASMN1; SMN2ALDH1A1MEN1
SCHEMBL23844181 0.68 BRAF (0.58) MAPTLMNASMN1; SMN2ALDH1A1MEN1
SCHEMBL5490431 0.68 RAB9A (0.66) MAPTLMNASMN1; SMN2ALDH1A1MEN1
SCHEMBL6841257 0.67 RAB9A (0.55) SMN1; SMN2ALDH1A1MEN1KMT2AHTT
SCHEMBL6846471 0.66 NPY2R (0.49) MAPTLMNASMN1; SMN2ALDH1A1ALOX12
SCHEMBL17409720 0.65 KCNK3 (0.70) MAPTALDH1A1MEN1KMT2ANPSR1
SCHEMBL6841293 0.65 TSHR (0.64) MAPTLMNAALDH1A1MEN1KMT2A
SCHEMBL15613030 0.65 HTR2B (0.53) MAPTLMNASMN1; SMN2ALDH1A1MEN1
SCHEMBL6841347 0.64 KCNK3 (0.42) MAPTSMN1; SMN2ALDH1A1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040092747-A1 Amide compounds and pharmaceutical compositions for inhibiting protein kinases, and methods for their use BENDER STEVEN LEE (US) 2004-05-13 US disclosed
US-6635641-B2 For treating cancer and other disease states associated with unwanted angiogenesis and/or cellular proliferation such as diabetic retinopathy, neovascular glaucoma, rheumatoid arthritis, psoriasis AGOURON PHARMACEUTICALS, INC. 2003-10-21 US disclosed
EP-1252146-A1 AMIDE COMPOUNDS FOR INHIBITING PROTEIN KINASES AGOURON PHARMACEUTICALS, INC. (US) 2002-10-30 EP disclosed
US-20020103203-A1 Amide compounds and pharmaceutical compositions for inhibiting protein kinases, and methods for their use AGOURON PHARMACEUTICALS, INC. 2002-08-01 US disclosed
WO-2001053274-A1 AMIDE COMPOUNDS FOR INHIBITING PROTEIN KINASES AGOURON PHARMACEUTICALS, INC. (US) 2001-07-26 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-20040092747-A1 Amide compounds and pharmaceutical compositions for inhibiting protein kinases, and methods for their use BRAF, CNKSR1, UACA MAPT 899/4885LMNA 4001/4885SMN1; SMN2 4682/4885
US-20020103203-A1 Amide compounds and pharmaceutical compositions for inhibiting protein kinases, and methods for their use BRAF, CNKSR1, UACA MAPT 899/4885LMNA 4001/4885SMN1; SMN2 4682/4885

“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.