SCHEMBL19786460

SCHEMBL19786460

CCc1c(C)ccc2cn[nH]c12

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.58
ALDH1A1 P00352 3/20 0.46
HTT P42858 1/20 0.46
NOS1 P29475 3/20 0.39
CYP1A2 P05177 2/20 0.37
CYP3A4 P08684 2/20 0.37
CYP2C19 P33261 2/20 0.37
CYP2C9 P11712 1/20 0.37
TRPA1 O75762 2/20 0.36
NOS3 P29474 2/20 0.35
NOS2 P35228 2/20 0.35
ADORA1 P30542 1/20 0.35
FGFR1 P11362 2/20 0.35
KDM4E B2RXH2 2/20 0.34
PLK4 O00444 1/20 0.34
CHEK1 O14757 1/20 0.34
AURKA O14965 1/20 0.34
DAPK3 O43293 1/20 0.34
MAP4K4 O95819 1/20 0.34
CSF1R P07333 1/20 0.34

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
SCHEMBL23678202 0.86 MAPT (0.54) MAPTALDH1A1HTTNOS1CYP1A2
SCHEMBL19304120 0.80 MAPT (0.43) MAPTALDH1A1HTTNOS1CYP1A2
SCHEMBL6977303 0.80 MAPT (0.51) MAPTALDH1A1HTTNOS1CYP1A2
SCHEMBL8404431 0.76 MAPT (0.66) MAPTALDH1A1HTTNOS1CYP1A2
SCHEMBL12121763 0.75 MAPT (0.63) MAPTALDH1A1HTTNOS1CYP1A2
SCHEMBL8305143 0.74 MAPT (0.56) MAPTALDH1A1NOS1CYP1A2CYP3A4
SCHEMBL7581318 0.73 MAPT (1.00) MAPTALDH1A1HTTNOS1CYP1A2
SCHEMBL2268804 0.73 MAPT (0.61) MAPTALDH1A1HTTNOS1CYP1A2
SCHEMBL23083828 0.73 MAPT (0.61) MAPTALDH1A1HTTNOS1CYP1A2
SCHEMBL16061625 0.73 MAPT (0.61) MAPTALDH1A1HTTNOS1CYP1A2

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-20240226113-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF KUMQUAT BIOSCIENCES INC. 2024-07-11 US disclosed
US-20220281893-A1 TETRACYCLIC OXAZEPINE COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2022-09-08 US disclosed
EP-3558955-B1 BENZISOTHIAZOLE, ISOTHIAZOLO[3,4-B]PYRIDINE, QUINAZOLINE, PHTHALAZINE, PYRIDO[2,3-D]PYRIDAZINE AND PYRIDO[2,3-D]PYRIMIDINE DERIVATIVES AS KRAS G12C INHIBITORS FOR TREATING LUNG, PANCREATIC OR COLORECTAL CANCER AMGEN INC (US) 2021-08-11 EP disclosed
US-10646488-B2 Conjugates of cereblon binding compounds and G12C mutant KRAS, HRAS or NRAS protein modulating compounds and methods of use thereof ARAXES PHARMA LLC (US) 2020-05-12 US disclosed
US-20180015087-A1 CONJUGATES OF CEREBLON BINDING COMPOUNDS AND G12C MUTANT KRAS, HRAS OR NRAS PROTEIN MODULATING COMPOUNDS AND METHODS OF USE THEREOF ARAXES PHARMA LLC 2018-01-18 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 (4 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-20180015087-A1 CONJUGATES OF CEREBLON BINDING COMPOUNDS AND G12C MUTANT KRAS, HRAS OR NRAS PROTEIN MODULATING COMPOUNDS AND METHODS OF USE THEREOF KRAS, NRAS, HRAS MAPT 4115/4885ALDH1A1 3952/4885HTT 604/4885
US-10646488-B2 Conjugates of cereblon binding compounds and G12C mutant KRAS, HRAS or NRAS protein modulating compounds and methods of use thereof KRAS, NRAS, HRAS MAPT 4115/4885ALDH1A1 3952/4885HTT 604/4885
US-20220281893-A1 TETRACYCLIC OXAZEPINE COMPOUNDS AND USES THEREOF OXA1L, CACNA1I, GRIK5 MAPT 1359/4885ALDH1A1 1402/4885HTT 1623/4885
US-20240226113-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF TP53, HRAS, KRAS MAPT 2968/4885ALDH1A1 2917/4885HTT 406/4885

“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.