SCHEMBL765022

SCHEMBL765022

Cc1ccc(C(=O)NCC2COC(C)(C)O2)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 3/20 0.61
CA2 P00918 1/20 0.47
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
MMP13 P45452 1/20 0.45
GAA P10253 1/20 0.45
RAB9A P51151 4/20 0.44
SMN1; SMN2 Q16637 4/20 0.44
NPC1 O15118 2/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
TSHR P16473 1/20 0.43
HPGD P15428 3/20 0.43
POLB P06746 3/20 0.43
LMNA P02545 2/20 0.43
MAPK14 Q16539 1/20 0.42
OPRM1 P35372 2/20 0.42
OPRK1 P41145 1/20 0.42
MAPT P10636 1/20 0.42

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
SCHEMBL12835155 0.88 NAMPT (0.60) NAMPTCA2MEN1KMT2ARAB9A
SCHEMBL3431782 0.88 NAMPT (0.65) NAMPTCA2MEN1KMT2AGAA
SCHEMBL3034203 0.85 NAMPT (0.57) NAMPTCA2MEN1KMT2ARAB9A
SCHEMBL959795 0.81 KMT2A (0.58) MEN1KMT2AMMP13GAARAB9A
SCHEMBL15226041 0.78 CA2 (0.54) NAMPTCA2ALDH1A1NPSR1
SCHEMBL19876834 0.78 NAMPT (0.50) NAMPTCA2MEN1KMT2ARAB9A
SCHEMBL3704902 0.77 NAMPT (1.00) NAMPT
SCHEMBL3699364 0.77 NAMPT (1.00) NAMPT
SCHEMBL3708399 0.77 NAMPT (1.00) NAMPT
SCHEMBL30408367 0.77 NPC1 (0.46) NAMPTMEN1KMT2AGAARAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112341423-B Water-soluble alkyne amide condensing agent and preparation method and application thereof 江西师范大学 2021-11-05 CN disclosed
CN-112341423-A Water-soluble alkyne amide condensing agent and preparation method and application thereof 江西师范大学 2021-02-09 CN disclosed
US-8372860-B2 Carboline derivatives useful in the inhibition of angiogenesis PTC THERAPEUTICS, INC. (US) 2013-02-12 US disclosed
US-20100179132-A1 CARBOLINE DERIVATIVES USEFUL IN THE INHIBITION OF ANGIOGENESIS PTC THERAPEUTICS, INC. 2010-07-15 US disclosed
US-20100158858-A1 ADMINISTRATION OF CARBOLINE DERIVATIVES USEFUL IN THE TREATMENT OF CANCER AND OTHER DISEASES PTC THERAPEUTICS, INC. 2010-06-24 US disclosed
US-20100158858-A1 ADMINISTRATION OF CARBOLINE DERIVATIVES USEFUL IN THE TREATMENT OF CANCER AND OTHER DISEASES PTC THERAPEUTICS, INC. 2010-06-24 US disclosed
US-7601840-B2 Carboline derivatives useful in the inhibition of angiogenesis PTC THERAPEUTICS, INC. (US) 2009-10-13 US disclosed
US-20070281962-A2 Administering 1,2,3,6-tetrasubstituted pyrido[3,4-b]indoles to inhibit the 5'-untranslated region-dependent translation; anticarcinogenic agents; retinopathy, rheumatoid arthritis, psoriasis, atherosclerosis, obesity, macular degeneration PCT THERAPEUTICS, INC. (US) 2007-12-06 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-20100158858-A1 ADMINISTRATION OF CARBOLINE DERIVATIVES USEFUL IN THE TREATMENT OF CANCER AND OTHER DISEASES RNMT, VEGFA, VHL NAMPT 711/4885CA2 1869/4885MEN1 3024/4885
US-20070281962-A2 Administering 1,2,3,6-tetrasubstituted pyrido[3,4-b]indoles to inhibit the 5'-untranslated region-dependent translation; anticarcinogenic agents; retinopathy, rheumatoid arthritis, psoriasis, atherosclerosis, obesity, macular degeneration VEGFA, FLT4, MIF NAMPT 922/4885CA2 4487/4885MEN1 4693/4885
US-20100179132-A1 CARBOLINE DERIVATIVES USEFUL IN THE INHIBITION OF ANGIOGENESIS VEGFA, FLT4, PGF NAMPT 1476/4885CA2 1067/4885MEN1 4147/4885

“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.