SCHEMBL26804979

SCHEMBL26804979

CC(OC(=O)OC1CCCCC1)OC(=O)c1ccc(C(C)(C)C)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 2/20 0.46
▸ SMN1; SMN2 Q16637 2/20 0.46
▸ HTT P42858 2/20 0.46
▸ NPC1 O15118 1/20 0.46
▸ ALDH1A1 P00352 2/20 0.43
▸ HPGD P15428 1/20 0.43
▸ MEN1 O00255 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ LMNA P02545 2/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ CYP2D6 P10635 1/20 0.41
▸ SCN1A P35498 1/20 0.41
▸ SCN2A Q99250 1/20 0.41
▸ SCN3A Q9NY46 1/20 0.41
▸ CYP19A1 P11511 1/20 0.40
▸ STS P08842 4/20 0.40
▸ MAPT P10636 1/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.40
▸ GRIN2C Q14957 1/20 0.39
▸ SLC6A2 P23975 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
SCHEMBL25913609 0.86 SCN1A (0.48) RAB9ASMN1; SMN2HTTNPC1ALDH1A1
SCHEMBL24848168 0.85 MEN1 (0.46) RAB9ASMN1; SMN2HTTNPC1ALDH1A1
SCHEMBL5010378 0.85 PARP10 (0.44) RAB9ASMN1; SMN2HTTNPC1ALDH1A1
SCHEMBL25920617 0.84 LMNA (0.56) RAB9ASMN1; SMN2HTTNPC1MEN1
SCHEMBL5010823 0.82 SMN1; SMN2 (0.49) RAB9ASMN1; SMN2HTTNPC1ALDH1A1
SCHEMBL6865989 0.75 ACHE (0.41) RAB9ANPC1LMNACYP1A2CYP2D6
SCHEMBL9963862 0.75 SMN1; SMN2 (0.38) RAB9ASMN1; SMN2HTTNPC1LMNA
SCHEMBL15607733 0.75 MAPT (0.56) RAB9ASMN1; SMN2HTTNPC1ALDH1A1
SCHEMBL5542628 0.74 CYP19A1 (0.42) RAB9ASMN1; SMN2HTTNPC1ALDH1A1
SCHEMBL1378229 0.74 HPGD (0.38) RAB9ASMN1; SMN2HTTNPC1ALDH1A1

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-20230373972-A1 PIPERAZINE DERIVATIVE, PREPARATION METHOD THEREFOR AND USE THEREOF ZHEJIANG HISUN PHARMACEUTICAL CO., LTD. (CN) 2023-11-23 — — US disclosed
US-20230373972-A1 PIPERAZINE DERIVATIVE, PREPARATION METHOD THEREFOR AND USE THEREOF ZHEJIANG HISUN PHARMACEUTICAL CO., LTD. (CN) 2023-11-23 — — 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 (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-20230373972-A1 PIPERAZINE DERIVATIVE, PREPARATION METHOD THEREFOR AND USE THEREOF F7, F11, HABP2 RAB9A 3518/4885SMN1; SMN2 4054/4885HTT 3849/4885

“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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