SCHEMBL22461002

SCHEMBL22461002

Cc1ccccc1/C=C/C(=O)Cc1cccs1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 8/20 0.49
▸ NPC1 O15118 4/20 0.49
▸ POLB P06746 2/20 0.49
▸ ALDH1A1 P00352 6/20 0.46
▸ HPGD P15428 5/20 0.46
▸ L3MBTL1 Q9Y468 2/20 0.44
▸ HTT P42858 1/20 0.44
▸ SMN1; SMN2 Q16637 5/20 0.43
▸ LMNA P02545 1/20 0.43
▸ KDM4E B2RXH2 1/20 0.42
▸ PKM P14618 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41
▸ MEN1 O00255 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ TP53 P04637 1/20 0.40
▸ MAPT P10636 1/20 0.40

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
SCHEMBL22445612 1.00 RAB9A (0.49) RAB9ANPC1POLBALDH1A1HPGD
SCHEMBL22445611 1.00 RAB9A (0.49) RAB9ANPC1POLBALDH1A1HPGD
SCHEMBL22461004 0.84 RAB9A (0.44) RAB9ANPC1POLBALDH1A1HPGD
SCHEMBL11796588 0.79 SMN1; SMN2 (0.59) RAB9ANPC1POLBALDH1A1HPGD
SCHEMBL11796584 0.79 SMN1; SMN2 (0.59) RAB9ANPC1POLBALDH1A1HPGD
SCHEMBL2720009 0.77 TRPM8 (0.69) NPC1ALDH1A1L3MBTL1HTT
SCHEMBL2720006 0.77 TRPM8 (0.69) NPC1ALDH1A1L3MBTL1HTT
SCHEMBL13287300 0.75 IAPP (0.60) RAB9AALDH1A1SMN1; SMN2LMNAKDM4E
SCHEMBL3362442 0.75 IAPP (0.60) RAB9AALDH1A1SMN1; SMN2LMNAKDM4E
SCHEMBL27832643 0.75 IAPP (0.60) RAB9AALDH1A1SMN1; SMN2LMNAKDM4E

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-20220177488-A1 SUMO INHIBITOR COMPOUNDS AND USES THEREOF CIT THERAPEUTICS LLC 2022-06-09 — — US disclosed
WO-2020191151-A1 SUMO INHIBITOR COMPOUNDS AND USES THEREOF ONCOVALENT THERAPEUTICS INC. (US) 2020-09-24 — — 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 (1 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-20220177488-A1 SUMO INHIBITOR COMPOUNDS AND USES THEREOF SUMO1, SUMO2, SUMO3 RAB9A 2154/4885NPC1 2611/4885POLB 2331/4885

“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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