SCHEMBL24162901

SCHEMBL24162901

COc1cccc(-c2nc3ccc(C(=O)N(C)CCC4CCCCO4)cc3o2)c1

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 10/20 0.56
▸ RAB9A P51151 10/20 0.56
▸ KMT2A Q03164 5/20 0.53
▸ MEN1 O00255 3/20 0.53
▸ POLB P06746 2/20 0.53
▸ HSP90AA1 P07900 1/20 0.53
▸ LMNA P02545 3/20 0.46
▸ CASP3 P42574 1/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.45
▸ ALDH1A1 P00352 2/20 0.44
▸ GPR119 Q8TDV5 2/20 0.43
▸ HPGD P15428 1/20 0.43
▸ GAA P10253 1/20 0.43
▸ MAPT P10636 1/20 0.42
▸ PKM P14618 1/20 0.42
▸ NPSR1 Q6W5P4 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42

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
SCHEMBL24162952 0.84 HPGD (0.64) NPC1RAB9AKMT2AMEN1POLB
SCHEMBL25414340 0.84 OXTR (0.56) NPC1RAB9AKMT2AMEN1POLB
SCHEMBL24162954 0.81 HPGD (0.68) NPC1RAB9AKMT2AMEN1POLB
SCHEMBL24163917 0.78 NPC1 (0.51) NPC1RAB9AKMT2AMEN1POLB
SCHEMBL1675462 0.76 NPC1 (0.63) NPC1RAB9AKMT2AMEN1POLB
SCHEMBL24163482 0.76 NPC1 (0.56) NPC1RAB9AKMT2AMEN1POLB
SCHEMBL24162909 0.75 NPC1 (0.50) NPC1RAB9AKMT2AMEN1POLB
SCHEMBL24162900 0.75 NPC1 (0.51) NPC1RAB9AKMT2AMEN1POLB
SCHEMBL24162903 0.74 MAPT (0.45) NPC1RAB9AKMT2APOLBSMN1; SMN2
SCHEMBL24163750 0.73 NPC1 (0.48) NPC1RAB9AKMT2AMEN1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230255906-A1 Targeting Serpin B9 in Cancer THE BRIGHAM AND WOMEN'S HOSPITAL, INC. 2023-08-17 — — US claimed
US-20230255906-A1 Targeting Serpin B9 in Cancer THE BRIGHAM AND WOMEN'S HOSPITAL, INC. 2023-08-17 — — US disclosed
US-20230255906-A1 Targeting Serpin B9 in Cancer THE BRIGHAM AND WOMEN'S HOSPITAL, INC. 2023-08-17 — — US disclosed
US-20230255906-A1 Targeting Serpin B9 in Cancer THE BRIGHAM AND WOMEN'S HOSPITAL, INC. 2023-08-17 — — US disclosed
WO-2022006534-A1 TARGETING SERPIN B9 IN CANCER THE BRIGHAM AND WOMEN'S HOSPITAL, INC. (US) 2022-01-06 — — 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-20230255906-A1 Targeting Serpin B9 in Cancer SERPINB10, SERPINB8, SERPINE1 NPC1 1048/4885RAB9A 338/4885KMT2A 4568/4885

“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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