SCHEMBL10247150

SCHEMBL10247150

C[C@@H]1CCc2ccc(O)cc2C1

nearest known ligand 0.62

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 12/20 0.62
DRD2 P14416 11/20 0.62
DRD4 P21917 7/20 0.62
MEN1 O00255 2/20 0.54
KMT2A Q03164 2/20 0.54
HTR1A P08908 1/20 0.54
ADRB2 P07550 1/20 0.54
CYP2D6 P10635 1/20 0.54
CASP1 P29466 1/20 0.54
OPRK1 P41145 1/20 0.53
LMNA P02545 2/20 0.53
MAPT P10636 1/20 0.53
CA1 P00915 3/20 0.51
CA2 P00918 3/20 0.51
ACHE P22303 3/20 0.51
CYP19A1 P11511 1/20 0.49
CNR2 P34972 1/20 0.46
ALDH1A1 P00352 1/20 0.44

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
SCHEMBL10247281 1.00 DRD3 (0.62) DRD3DRD2DRD4MEN1KMT2A
SCHEMBL24540244 0.92 OPRK1 (0.62) DRD3DRD2DRD4MEN1KMT2A
SCHEMBL629321 0.92 OPRK1 (0.62) DRD3DRD2DRD4MEN1KMT2A
SCHEMBL18566685 0.92 OPRK1 (0.62) DRD3DRD2DRD4MEN1KMT2A
SCHEMBL23474196 0.88 DRD2 (0.56) DRD3DRD2DRD4MEN1KMT2A
SCHEMBL13799411 0.84 DRD2 (0.50) DRD3DRD2DRD4MEN1KMT2A
SCHEMBL13799412 0.81 HTR2A (0.46) DRD3DRD2DRD4HTR1A
SCHEMBL2564622 0.78 DRD3 (0.65) DRD3DRD2DRD4MEN1KMT2A
SCHEMBL30199160 0.78 DRD3 (0.65) DRD3DRD2DRD4MEN1KMT2A
SCHEMBL597666 0.78 SRD5A1 (0.42) DRD3DRD2DRD4LMNAMAPT

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
WO-2022133027-A1 SUBSTITUTED CYCLOHEXANECARBOXAMIDES, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION SANOFI (FR) 2022-06-23 WO disclosed
US-20140256947-A1 PREPARATION OF AMINOTETRALIN COMPOUNDS MILLENNIUM PHARMACEUTICALS, INC. (US) 2014-09-11 US disclosed
US-20140243335-A1 SUBSTITUTED HYDOXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2014-08-28 US disclosed
US-20120015943-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACUTICALS, INC. (US) 2012-01-19 US disclosed
US-20100197924-A1 PREPARATION OF AMINOTETRALIN COMPOUNDS MILLENNIUM PHARMACEUTICALS, INC. (US) 2010-08-05 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 (4 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-20100197924-A1 PREPARATION OF AMINOTETRALIN COMPOUNDS MAP4K5, MAP4K2, MAP4K1 DRD3 1669/4885DRD2 1302/4885DRD4 1175/4885
US-20140256947-A1 PREPARATION OF AMINOTETRALIN COMPOUNDS MAP4K5, MAP4K2, MAP4K1 DRD3 1669/4885DRD2 1302/4885DRD4 1175/4885
US-20120015943-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF HDAC6, HDAC1, HDAC2 DRD3 2383/4885DRD2 2063/4885DRD4 2585/4885
US-20140243335-A1 SUBSTITUTED HYDOXAMIC ACIDS AND USES THEREOF HDAC6, HDAC1, H1-3 DRD3 2036/4885DRD2 1964/4885DRD4 2482/4885

“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.