SCHEMBL22111664

SCHEMBL22111664

Cc1ccc(C2CC(=O)/C(=C/O)C(O)C2)cc1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MAP1LC3B Q9GZQ8 9/20 0.47
▸ HPGD P15428 1/20 0.40
▸ TSHR P16473 2/20 0.34
▸ RXFP1 Q9HBX9 1/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ NPC1 O15118 1/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ SLC18A3 Q16572 1/20 0.33
▸ MAOB P27338 4/20 0.33
▸ CYP3A4 P08684 1/20 0.32
▸ CYP2C9 P11712 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32

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
SCHEMBL21821615 0.76 MAP1LC3B (0.66) MAP1LC3BHPGDTSHRRXFP1MEN1
SCHEMBL22111739 0.69 HTR2C (0.35) MAP1LC3B
SCHEMBL21792641 0.68 MAP1LC3B (0.40) MAP1LC3BHPGDTSHRMEN1RAB9A
SCHEMBL21795165 0.67 MAP1LC3B (0.68) MAP1LC3BHPGDTSHRRXFP1MEN1
SCHEMBL22111821 0.65 HPGD (0.62) MAP1LC3BHPGDCYP2C9CYP2C19
SCHEMBL19294268 0.65 SLC18A3 (0.44) MAP1LC3BRAB9ASLC18A3CYP3A4CYP2C9
SCHEMBL25553472 0.65 SLC18A3 (0.44) MAP1LC3BRAB9ASLC18A3CYP3A4CYP2C9
SCHEMBL20284994 0.65 SLC18A3 (0.44) MAP1LC3BRAB9ASLC18A3CYP3A4CYP2C9
SCHEMBL428432 0.65 MAP1LC3B (0.55) MAP1LC3BHPGDMEN1KMT2AMAOB
SCHEMBL1779869 0.64 MAP1LC3B (1.00) MAP1LC3BHPGDTSHRRXFP1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11319303-B2 Compound used as autophagy regulator, and preparation method therefor and uses thereof Wigen Biomedicine Technology (shanghai) Co., Ltd. (CN) 2022-05-03 — — US disclosed
US-20200190066-A1 COMPOUND USED AS AUTOPHAGY REGULATOR, AND PREPARATION METHOD THEREFOR AND USES THEREOF Wigen Biomedicine Technology (shanghai) Co., Ltd. (CN) 2020-06-18 — — 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-11319303-B2 Compound used as autophagy regulator, and preparation method therefor and uses thereof ATG7, SQSTM1, BECN1 MAP1LC3B 15/4885HPGD 3647/4885TSHR 4336/4885
US-20200190066-A1 COMPOUND USED AS AUTOPHAGY REGULATOR, AND PREPARATION METHOD THEREFOR AND USES THEREOF ATG7, SQSTM1, BECN1 MAP1LC3B 15/4885HPGD 3647/4885TSHR 4336/4885

“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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