SCHEMBL7127591

SCHEMBL7127591

CCOC(=O)c1nnc(Sc2ccc(Cl)cc2)s1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.48
NPC1 O15118 4/20 0.48
MAPT P10636 3/20 0.48
MEN1 O00255 3/20 0.48
TRPM8 Q7Z2W7 1/20 0.44
IDO1 P14902 1/20 0.43
ABCC1 P33527 1/20 0.42
PRKCZ Q05513 1/20 0.41
SMN1; SMN2 Q16637 4/20 0.41
HPGD P15428 2/20 0.41
NPSR1 Q6W5P4 2/20 0.41
ALDH1A1 P00352 3/20 0.41
RAB9A P51151 3/20 0.40
LMNA P02545 2/20 0.40
HTT P42858 2/20 0.40
HSD11B1 P28845 1/20 0.40
GAA P10253 1/20 0.40
ALPL P05186 1/20 0.40
TARBP2 Q15633 1/20 0.40
CYP1A2 P05177 2/20 0.39

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
SCHEMBL7062156 0.86 ALDH1A1 (0.45) NPC1MAPTTRPM8SMN1; SMN2HPGD
SCHEMBL25994983 0.79 HAO1 (0.44) KMT2ANPC1MAPTMEN1SMN1; SMN2
SCHEMBL20487167 0.78 USP7 (0.50) NPC1MAPTIDO1SMN1; SMN2NPSR1
SCHEMBL16400376 0.77 EGFR (0.56) KMT2ANPC1MAPTMEN1TRPM8
SCHEMBL25353950 0.76 CA1 (0.41) KMT2ANPC1MAPTMEN1SMN1; SMN2
SCHEMBL9332597 0.75 LMNA (0.53) KMT2ANPC1MAPTMEN1SMN1; SMN2
SCHEMBL281865 0.75 MAPT (0.43) KMT2ANPC1MAPTMEN1TRPM8
SCHEMBL11356302 0.74 ALDH1A1 (0.48) KMT2ANPC1MAPTMEN1SMN1; SMN2
SCHEMBL9332593 0.74 ALDH1A1 (0.41) KMT2ANPC1MAPTSMN1; SMN2HPGD
SCHEMBL17967187 0.74 KDM4E (0.48) KMT2ANPC1MAPTMEN1TRPM8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230233533-A1 COMPOSITIONS, METHODS OF TREATING AND PREVENTING FUNGAL INFECTIONS, AND METHODS OF INHIBITING PRP8 INTEIN EXPRESSION HEALTH RESEARCH, INC. (US) 2023-07-27 US disclosed
US-20230233533-A1 COMPOSITIONS, METHODS OF TREATING AND PREVENTING FUNGAL INFECTIONS, AND METHODS OF INHIBITING PRP8 INTEIN EXPRESSION HEALTH RESEARCH, INC. (US) 2023-07-27 US disclosed
US-20230233533-A1 COMPOSITIONS, METHODS OF TREATING AND PREVENTING FUNGAL INFECTIONS, AND METHODS OF INHIBITING PRP8 INTEIN EXPRESSION HEALTH RESEARCH, INC. (US) 2023-07-27 US disclosed
WO-2021252068-A1 COMPOSITIONS, METHODS OF TREATING AND PREVENTING FUNGAL INFECTIONS, AND METHODS OF INHIBITING PRP8 INTEIN EXPRESSION HEALTH RESEARCH, INC. (US) 2021-12-16 WO disclosed
US-6599916-B2 Treating a disease or condition in a mammal, wherein the alpha 7 nicotinic acetylcholine receptor is implicated, Alzheimer's disease, pre-senile dementia (mild cognitive impairment), or senile dementia. PHARMACIA & UPJOHN COMPANY 2003-07-29 US disclosed
EP-1311505-A2 QUINUCLIDINE-SUBSTITUTED HETEROARYL MOIETIES FOR TREATMENT OF DISEASE ( NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS ) PHARMACIA & UPJOHN COMPANY (US) 2003-05-21 EP disclosed
US-6500840-B2 CENTRAL NERVOUS SYSTEM DISORDERS PHARMACIA & UPJOHN COMPANY 2002-12-31 US disclosed
US-20020091135-A1 Quinuclidine-substituted heteroaryl moieties for treatment of disease PHARMACIA & UPJOHN COMPANY GLOBAL INTELLECTUAL PROPERTY 2002-07-11 US disclosed
US-20020042428-A1 Quinuclidine-substituted heteroaryl moieties for treatment of disease PHARMACIA & UPJOHN COMPANY 2002-04-11 US disclosed
US-20020042429-A1 Quinuclidine-substituted heteroaryl moieties for treatment of disease PHARMACIA & UPJOHN COMPANY 2002-04-11 US disclosed
WO-2002015662-A2 QUINUCLIDINE-SUBSTITUTED HETEROARYL MOIETIES FOR TREATMENT OF DISEASE (NICOTINIC ACETYLCHOLINE RECEPTOR ANTAGONISTS PHARMACIA & UPJOHN COMPANY (US) 2002-02-28 WO disclosed
WO-2002016355-A2 QUINUCLIDINE-SUBSTITUTED HETEROARYL MOIETIES FOR TREATMENT OF DISEASE (NICOTINIC) ACETYLCHOLINE RECEPTOR LIGANDS PHARMACIA & UPJOHN COMPANY (US) 2002-02-28 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 (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-20230233533-A1 COMPOSITIONS, METHODS OF TREATING AND PREVENTING FUNGAL INFECTIONS, AND METHODS OF INHIBITING PRP8 INTEIN EXPRESSION PRPF8, PRPF40A, PRPF19 KMT2A 3617/4885NPC1 1307/4885MAPT 3765/4885
US-20020042428-A1 Quinuclidine-substituted heteroaryl moieties for treatment of disease NQO2, GBA1, UGT1A1 KMT2A 3388/4885NPC1 33/4885MAPT 1250/4885
US-20020042429-A1 Quinuclidine-substituted heteroaryl moieties for treatment of disease PARK7, CYP3A7, UGT2B7 KMT2A 4150/4885NPC1 51/4885MAPT 1546/4885
US-20020091135-A1 Quinuclidine-substituted heteroaryl moieties for treatment of disease NQO2, GBA1, UGT1A1 KMT2A 3388/4885NPC1 33/4885MAPT 1250/4885

“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.