SCHEMBL924440

SCHEMBL924440

COC(=O)C1C(=O)CCc2nc(OC)ccc21

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
RORC P51449 8/20 0.37
DRD2 P14416 1/20 0.36
DRD1 P21728 1/20 0.36
POLB P06746 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
MTNR1A P48039 6/20 0.35
MTNR1B P49286 6/20 0.35
HTR2C P28335 3/20 0.35
NNMT P40261 1/20 0.35
DDB1 Q16531 1/20 0.34
CRBN Q96SW2 1/20 0.34
GRM5 P41594 1/20 0.33

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
SCHEMBL31397659 1.00 RORC (0.37) RORCDRD2DRD1POLBTDP1
SCHEMBL17656944 0.75 DRD2 (0.40) RORCDRD2DRD1POLBTDP1
SCHEMBL8997679 0.71 MTNR1A (0.32) MTNR1AMTNR1BHTR2C
SCHEMBL2597463 0.70 BRD4 (0.45)
SCHEMBL50426 0.70 KDM4E (0.49) POLBTDP1MTNR1AMTNR1B
SCHEMBL8116003 0.70 SRD5A1 (0.47) DRD1TDP1MTNR1AMTNR1BHTR2C
SCHEMBL31137696 0.69 DRD2 (0.43) RORCDRD2DRD1POLBTDP1
SCHEMBL5400138 0.68 CHRM2 (0.45) POLB
SCHEMBL17660751 0.68 DRD2 (0.40) RORCDRD2DRD1POLBTDP1
SCHEMBL28447625 0.67 DRD2 (0.41) RORCDRD2DRD1POLBTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119431243-B Deuterated huperzine A compound or pharmaceutically acceptable salt thereof as well as preparation method and application thereof 万邦德制药集团有限公司 2025-06-10 CN claimed
CN-119431243-A Deuterated huperzine A compound or pharmaceutically acceptable salt thereof as well as preparation method and application thereof 万邦德制药集团有限公司 2025-02-14 CN claimed
CN-119431243-B Deuterated huperzine A compound or pharmaceutically acceptable salt thereof as well as preparation method and application thereof 万邦德制药集团有限公司 2025-06-10 CN disclosed
CN-119431243-A Deuterated huperzine A compound or pharmaceutically acceptable salt thereof as well as preparation method and application thereof 万邦德制药集团有限公司 2025-02-14 CN disclosed
US-9586904-B2 Preparation of (−)-huperzine A ZHEJIANG WANBANG PHARMACEUTICAL PLC. (CN) 2017-03-07 US disclosed
US-9586904-B2 Preparation of (−)-huperzine A ZHEJIANG WANBANG PHARMACEUTICAL PLC. (CN) 2017-03-07 US disclosed
US-20160159745-A1 PREPARATION OF (-)-HUPERZINE A ZHEJIANG WANBANG PHARMACEUTICAL PLC. (CN) 2016-06-09 US disclosed
US-20160159745-A1 PREPARATION OF (-)-HUPERZINE A ZHEJIANG WANBANG PHARMACEUTICAL PLC. (CN) 2016-06-09 US disclosed
US-7868020-B2 Quinolynylmethylimidizoles as therapeutic agents ALLERGAN, INC. (US) 2011-01-11 US disclosed
US-7868020-B2 Quinolynylmethylimidizoles as therapeutic agents ALLERGAN, INC. (US) 2011-01-11 US disclosed
US-7868020-B2 Quinolynylmethylimidizoles as therapeutic agents ALLERGAN, INC. (US) 2011-01-11 US disclosed
US-20100113516-A1 QUINOLYNYLMETHYLIMIDIZOLES AS THERAPEUTIC AGENTS ALLERGAN, INC. (US) 2010-05-06 US disclosed
US-20100113516-A1 QUINOLYNYLMETHYLIMIDIZOLES AS THERAPEUTIC AGENTS ALLERGAN, INC. (US) 2010-05-06 US disclosed
US-20100113516-A1 QUINOLYNYLMETHYLIMIDIZOLES AS THERAPEUTIC AGENTS ALLERGAN, INC. (US) 2010-05-06 US disclosed
WO-2008088936-A1 QUINOLYNYLMETHYLIMIDIZOLES AS THERAPEUTIC AGENTS ALLERGAN, INC. (US) 2008-07-24 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-20160159745-A1 PREPARATION OF (-)-HUPERZINE A CYP8B1, HBZ, CYP3A5 RORC 355/4885DRD2 1810/4885DRD1 1081/4885
US-20100113516-A1 QUINOLYNYLMETHYLIMIDIZOLES AS THERAPEUTIC AGENTS TUBB3, TUBB1, NQO2 RORC 955/4885DRD2 4572/4885DRD1 4740/4885

“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.