SCHEMBL21113302

SCHEMBL21113302

CCOC(=O)c1cc2cc(-c3ccc(N)nc3)cn2c(C(C)=O)c1C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 10/20 0.39
NPC1 O15118 8/20 0.39
GAA P10253 6/20 0.39
MAPT P10636 6/20 0.39
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
CHEK2 O96017 1/20 0.39
EED O75530 1/20 0.39
RBBP4 Q09028 1/20 0.39
SUZ12 Q15022 1/20 0.39
EZH2 Q15910 1/20 0.39
AEBP2 Q6ZN18 1/20 0.39
SMN1; SMN2 Q16637 6/20 0.38
ALDH1A1 P00352 9/20 0.38
HSD17B10 Q99714 5/20 0.38
LMNA P02545 2/20 0.38
ALOX15 P16050 2/20 0.38
CSNK1D P48730 2/20 0.37

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
SCHEMBL21113259 0.82 RAB9A (0.48) RAB9ANPC1GAAMAPTMEN1
SCHEMBL21113459 0.82 ALDH1A1 (0.37) RAB9ANPC1GAAMAPTMEN1
SCHEMBL19964897 0.82 CASP1 (0.45) MAPTALDH1A1HSD17B10CSNK1DKDM4E
SCHEMBL21113045 0.82 ALDH1A1 (0.40) RAB9ANPC1GAAMAPTMEN1
SCHEMBL21113224 0.82 ALDH1A1 (0.44) RAB9ANPC1GAAMAPTMEN1
SCHEMBL21113150 0.81 EED (0.37) RAB9ANPC1GAAMAPTMEN1
SCHEMBL21113050 0.81 ALDH1A1 (0.41) RAB9ANPC1GAAMAPTMEN1
SCHEMBL21113246 0.80 BAZ2B (0.38) RAB9ANPC1GAAMAPTMEN1
SCHEMBL21113232 0.80 PIK3CD (0.38) RAB9ANPC1GAAMAPTMEN1
SCHEMBL21157356 0.79 MAPT (0.44) GAAMAPTMEN1KMT2ASMN1; 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10968215-B2 Pyrido five-element aromatic ring compound, preparation method therefor and use thereof SHANGHAI HAIHE PHARMACEUTICAL CO., LTD. (CN) 2021-04-06 US disclosed
US-10968215-B2 Pyrido five-element aromatic ring compound, preparation method therefor and use thereof SHANGHAI HAIHE PHARMACEUTICAL CO., LTD. (CN) 2021-04-06 US disclosed
EP-3524602-A1 PYRIDO FIVE-ELEMENT AROMATIC RING COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF Shanghai Haihe Pharmaceutical Co., Ltd. (CN) 2019-08-14 EP disclosed
US-20190211010-A1 PYRIDO FIVE-ELEMENT AROMATIC RING COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF HAIHE BIOPHARMA CO. LTD. (CN) 2019-07-11 US disclosed
US-20190211010-A1 PYRIDO FIVE-ELEMENT AROMATIC RING COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF HAIHE BIOPHARMA CO. LTD. (CN) 2019-07-11 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 (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-10968215-B2 Pyrido five-element aromatic ring compound, preparation method therefor and use thereof EZH2, IKZF2, SUZ12 RAB9A 2704/4885NPC1 4625/4885GAA 4565/4885
US-20190211010-A1 PYRIDO FIVE-ELEMENT AROMATIC RING COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF EZH2, IKZF2, SUZ12 RAB9A 2704/4885NPC1 4625/4885GAA 4565/4885

“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.