SCHEMBL21876812

SCHEMBL21876812

O=C(O)N1CCC(CN2CCN(c3ccc(I)cc3)CC2CO)CC1

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ AKR1C3 P42330 2/20 0.37
▸ DRD1 P21728 1/20 0.34
▸ DRD4 P21917 1/20 0.34
▸ DRD5 P21918 1/20 0.34
▸ DRD3 P35462 1/20 0.34
▸ KDM4E B2RXH2 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ NR1H2 P55055 5/20 0.33
▸ NR1H3 Q13133 4/20 0.33
▸ NOTUM Q6P988 3/20 0.32
▸ OPRK1 P41145 1/20 0.32

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
SCHEMBL21876810 1.00 AKR1C3 (0.37) AKR1C3DRD1DRD4DRD5DRD3
SCHEMBL21876855 0.87 ITGB3 (0.40) DRD1DRD4DRD5DRD3KDM4E
SCHEMBL21876854 0.87 ITGB3 (0.40) DRD1DRD4DRD5DRD3KDM4E
SCHEMBL21877127 0.84 GPR119 (0.47) KDM4EALDH1A1MAPT
SCHEMBL21876532 0.83 LTA4H (0.39) AKR1C3DRD1DRD4DRD5DRD3
SCHEMBL21876558 0.83 LTA4H (0.39) AKR1C3DRD1DRD4DRD5DRD3
SCHEMBL21877138 0.79 NR1H2 (0.36) NR1H2NR1H3
SCHEMBL21877157 0.76 AKR1C3 (0.41) AKR1C3DRD1DRD4DRD5DRD3
SCHEMBL21877154 0.76 AKR1C3 (0.41) AKR1C3DRD1DRD4DRD5DRD3
SCHEMBL2555420 0.71 AKR1C3 (0.65) AKR1C3ALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11986531-B2 Compounds and methods for the targeted degradation of rapidly accelerated fibrosarcoma polypeptides ARVINAS OPERATIONS, INC. (US) 2024-05-21 — — US disclosed
US-20230000994-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF RAPIDLY ACCELERATED FIBROSARCOMA POLYPEPTIDES YALE UNIVERSITY 2023-01-05 — — US disclosed
US-11173211-B2 Compounds and methods for the targeted degradation of rapidly accelerated Fibrosarcoma polypeptides ARVINAS OPERATIONS, INC. (US) 2021-11-16 — — US disclosed
CN-113164775-A Polycyclic compounds and methods for rapid accelerated targeted degradation of fibrosarcoma polypeptides 阿尔维纳斯运营股份有限公司 2021-07-23 — — CN disclosed
EP-3846907-A1 POLYCYCLIC COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF RAPIDLY ACCELERATED FIBROSARCOMA POLYPEPTIDES Arvinas Operations, Inc. (US) 2021-07-14 — — EP disclosed
US-20200129627-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF RAPIDLY ACCELERATED FIBROSARCOMA POLYPEPTIDES ARVINAS OPERATIONS, INC. 2020-04-30 — — 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-20200129627-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF RAPIDLY ACCELERATED FIBROSARCOMA POLYPEPTIDES CRBN, ARAF, VHL AKR1C3 1229/4885DRD1 4409/4885DRD4 4654/4885
US-11173211-B2 Compounds and methods for the targeted degradation of rapidly accelerated Fibrosarcoma polypeptides CRBN, ARAF, VHL AKR1C3 1229/4885DRD1 4409/4885DRD4 4654/4885
US-20230000994-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF RAPIDLY ACCELERATED FIBROSARCOMA POLYPEPTIDES CRBN, ARAF, VHL AKR1C3 1229/4885DRD1 4409/4885DRD4 4654/4885
US-11986531-B2 Compounds and methods for the targeted degradation of rapidly accelerated fibrosarcoma polypeptides CRBN, ARAF, VHL AKR1C3 1229/4885DRD1 4409/4885DRD4 4654/4885

“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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