SCHEMBL21157986

SCHEMBL21157986

COc1ccc(CCc2noc(=O)o2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 3/20 0.48
▸ NPC1 O15118 2/20 0.48
▸ L3MBTL1 Q9Y468 2/20 0.48
▸ MAPT P10636 2/20 0.48
▸ TDP1 Q9NUW8 1/20 0.47
▸ ALDH1A1 P00352 2/20 0.46
▸ POLB P06746 1/20 0.46
▸ SMN1; SMN2 Q16637 2/20 0.44
▸ KDM4E B2RXH2 1/20 0.44
▸ HSD17B10 Q99714 1/20 0.44
▸ TAAR1 Q96RJ0 1/20 0.43
▸ GSK3A P49840 1/20 0.43
▸ GSK3B P49841 1/20 0.43
▸ DAO P14920 2/20 0.42
▸ NR1H3 Q13133 2/20 0.42
▸ LMNA P02545 2/20 0.42
▸ F2RL1 P55085 1/20 0.41
▸ TUBB4A P04350 1/20 0.41
▸ TUBB P07437 1/20 0.41
▸ TUBA3C P0DPH7 1/20 0.41

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
SCHEMBL21148530 0.91 ALDH1A1 (0.57) MAPTALDH1A1POLBSMN1; SMN2TAAR1
SCHEMBL22554349 0.86 ALDH1A1 (0.54) RAB9ANPC1L3MBTL1MAPTTDP1
SCHEMBL21157261 0.82 TAAR1 (0.49) ALDH1A1TAAR1DAONR1H3NR3C2
SCHEMBL21157874 0.82 CYP1A2 (0.38) RAB9ANPC1L3MBTL1MAPTTDP1
SCHEMBL30866423 0.81 CYP19A1 (0.49) ALDH1A1POLBKDM4EDAONR1H3
SCHEMBL21156703 0.81 CYP19A1 (0.49) ALDH1A1POLBKDM4EDAONR1H3
SCHEMBL28419394 0.80 NR3C2 (0.34) RAB9ANPC1L3MBTL1MAPTTDP1
SCHEMBL21157240 0.79 ALDH1A1 (0.51) ALDH1A1POLBTAAR1DAOLMNA
SCHEMBL21121457 0.79 ESR1 (0.48) L3MBTL1TDP1ALDH1A1KDM4ETAAR1
SCHEMBL22554350 0.78 NPC1 (0.49) RAB9ANPC1L3MBTL1MAPTTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111587239-B Method for producing lactam compound and lactam compound produced by the method 基础科学研究院 2024-04-02 — — CN disclosed
US-11046661-B2 Method for producing lactam compound, and lactam compound produced thereby INSTITUTE FOR BASIC SCIENCE (KR) 2021-06-29 — — US disclosed
US-11046661-B2 Method for producing lactam compound, and lactam compound produced thereby INSTITUTE FOR BASIC SCIENCE (KR) 2021-06-29 — — US disclosed
US-20200331871-A1 METHOD FOR PRODUCING LACTAM COMPOUND, AND LACTAM COMPOUND PRODUCED THEREBY INSTITUTE FOR BASIC SCIENCE (KR) 2020-10-22 — — US disclosed
US-20200331871-A1 METHOD FOR PRODUCING LACTAM COMPOUND, AND LACTAM COMPOUND PRODUCED THEREBY INSTITUTE FOR BASIC SCIENCE (KR) 2020-10-22 — — US disclosed
CN-111587239-A Method for producing lactam compound and lactam compound produced by same 基础科学研究院 2020-08-25 — — CN disclosed
WO-2019135604-A1 METHOD FOR PRODUCING LACTAM COMPOUND, AND LACTAM COMPOUND PRODUCED THEREBY 기초과학연구원 2019-07-11 — — 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-20200331871-A1 METHOD FOR PRODUCING LACTAM COMPOUND, AND LACTAM COMPOUND PRODUCED THEREBY SQLE, COASY, DHPS RAB9A 3143/4885NPC1 3709/4885L3MBTL1 4513/4885
US-11046661-B2 Method for producing lactam compound, and lactam compound produced thereby SQLE, COASY, DHPS RAB9A 3143/4885NPC1 3709/4885L3MBTL1 4513/4885

“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.

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