SCHEMBL2805278

SCHEMBL2805278

NCCCn1cc(CC2(NC(=O)O)CC2)c2ccccc21

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CDC25A P30304 1/20 0.45
▸ CAMK2D Q13557 9/20 0.44
▸ ICMT O60725 1/20 0.44
▸ HDAC3 O15379 1/20 0.43
▸ PIM1 P11309 1/20 0.42
▸ TERT O14746 1/20 0.41
▸ MCL1 Q07820 3/20 0.40
▸ HTR6 P50406 1/20 0.39
▸ PRKACA P17612 1/20 0.39
▸ PRKACG P22612 1/20 0.39
▸ PRKACB P22694 1/20 0.39
▸ CNR1 P21554 2/20 0.39
▸ CNR2 P34972 2/20 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
SCHEMBL25360637 0.73 MAPT (0.61) CDC25ACAMK2DICMTHDAC3PIM1
SCHEMBL25360632 0.73 MAPT (0.61) CDC25ACAMK2DICMTHDAC3PIM1
SCHEMBL2805276 0.73 REN (0.54) CDC25AICMT
SCHEMBL2813360 0.70 CNR2 (0.42) HDAC3MCL1HTR6CNR1CNR2
SCHEMBL2465449 0.69 CDC25A (0.68) CDC25AICMTTERTMCL1HTR6
SCHEMBL2808561 0.69 SLC22A12 (0.42) HTR6CNR2
SCHEMBL21246049 0.68 ICMT (0.61) CDC25AICMTHDAC3TERTMCL1
SCHEMBL16259057 0.68 ICMT (0.61) CDC25ACAMK2DICMTHDAC3PIM1
SCHEMBL27774879 0.68 CAMK2D (0.43) CDC25ACAMK2DICMTPIM1HTR6
SCHEMBL2078403 0.68 CNR2 (0.79) CNR1CNR2

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-8975252-B2 Morpholine derivative SHANGHAI PHARMACEUTICALS HOLDING CO., LTD. (CN) 2015-03-10 — — US disclosed
US-20100240644-A1 MORPHOLINE DERIVATIVE SHANGHAI PHARMACEUTICALS HOLDING CO., LTD. (CN) 2010-09-23 — — 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-20100240644-A1 MORPHOLINE DERIVATIVE REN, AGTR1, AGTR2 CDC25A 2365/4885CAMK2D 1038/4885ICMT 1604/4885

“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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