SCHEMBL19327267

SCHEMBL19327267

COc1ccc(C=CCC2CCN(c3ccccc3OC)C2=O)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 2/20 0.45
▸ ATM Q13315 1/20 0.45
▸ NPC1 O15118 1/20 0.45
▸ DRD2 P14416 1/20 0.42
▸ DRD3 P35462 1/20 0.42
▸ KDM4E B2RXH2 4/20 0.42
▸ ALDH1A1 P00352 3/20 0.42
▸ MAPT P10636 2/20 0.42
▸ TSHR P16473 2/20 0.42
▸ HPGD P15428 2/20 0.42
▸ GLA P06280 1/20 0.42
▸ ALOX15 P16050 1/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ NPSR1 Q6W5P4 1/20 0.42
▸ HSD17B10 Q99714 1/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ LMNA P02545 3/20 0.40
▸ HSD11B1 P28845 1/20 0.40
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 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
SCHEMBL19327265 1.00 RAB9A (0.45) RAB9AATMNPC1DRD2DRD3
SCHEMBL19327278 0.92 ATM (0.47) RAB9AATMNPC1KDM4EALDH1A1
SCHEMBL19327277 0.92 ATM (0.47) RAB9AATMNPC1KDM4EALDH1A1
SCHEMBL19327322 0.91 ATM (0.47) ATMDRD2DRD3KDM4EALDH1A1
SCHEMBL19327321 0.91 ATM (0.47) ATMDRD2DRD3KDM4EALDH1A1
SCHEMBL19327329 0.91 LMNA (0.50) ATMDRD2DRD3KDM4EALDH1A1
SCHEMBL19327330 0.91 LMNA (0.50) ATMDRD2DRD3KDM4EALDH1A1
SCHEMBL19327249 0.85 ATM (0.46) RAB9AATMNPC1DRD2DRD3
SCHEMBL19327336 0.84 DRD2 (0.44) ATMDRD2DRD3KDM4EALDH1A1
SCHEMBL19327335 0.84 DRD2 (0.44) ATMDRD2DRD3KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11124503-B2 Compositions and methods for acylating lactams CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2021-09-21 — — US disclosed
US-20190077796-A1 COMPOSITIONS AND METHODS FOR ACYLATING LACTAMS CALIFORNIA INSTITUTE OF TECHNOLOGY 2019-03-14 — — US disclosed
US-10040784-B2 Compositions and methods for acylating lactams CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2018-08-07 — — US disclosed
US-20170260172-A1 COMPOSITIONS AND METHODS FOR ACYLATING LACTAMS CALIFORNIA INSTITUTE OF TECHNOLOGY 2017-09-14 — — 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-11124503-B2 Compositions and methods for acylating lactams COASY, ASNS, NAAA RAB9A 1724/4885ATM 3327/4885NPC1 1267/4885
US-20170260172-A1 COMPOSITIONS AND METHODS FOR ACYLATING LACTAMS COASY, NAAA, ASNS RAB9A 2063/4885ATM 2679/4885NPC1 1472/4885
US-10040784-B2 Compositions and methods for acylating lactams COASY, NAAA, ASNS RAB9A 2063/4885ATM 2679/4885NPC1 1472/4885
US-20190077796-A1 COMPOSITIONS AND METHODS FOR ACYLATING LACTAMS COASY, NAAA, ASNS RAB9A 2063/4885ATM 2679/4885NPC1 1472/4885

“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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