SCHEMBL1877903

SCHEMBL1877903

CC(C)C(=O)N[C@@H]1CCc2c(c3cc(Br)ccc3n2Cc2ccccc2)C1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 1/20 0.47
KRAS P01116 3/20 0.47
HDAC1 Q13547 1/20 0.47
HDAC6 Q9UBN7 1/20 0.47
PLA2G2A P14555 1/20 0.43
AKR1B10 O60218 1/20 0.43
AKR1A1 P14550 1/20 0.43
AKR1B1 P15121 1/20 0.43
MTNR1A P48039 1/20 0.41
MTNR1B P49286 1/20 0.41
HTR6 P50406 2/20 0.41
HTR1A P08908 1/20 0.41
HTR2A P28223 1/20 0.41
HTR7 P34969 1/20 0.41
XIAP P98170 1/20 0.40
SIGMAR1 Q99720 1/20 0.40

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
SCHEMBL1888567 1.00 PTGDR2 (0.47) PTGDR2KRASHDAC1HDAC6PLA2G2A
SCHEMBL1877905 1.00 PTGDR2 (0.47) PTGDR2KRASHDAC1HDAC6PLA2G2A
SCHEMBL1877855 0.90 PTGDR2 (0.48) PTGDR2KRASHDAC1HDAC6MTNR1A
SCHEMBL12637031 0.90 PTGDR2 (0.48) PTGDR2KRASHDAC1HDAC6MTNR1A
SCHEMBL1875342 0.87 PLA2G2A (0.51) PTGDR2HDAC1HDAC6PLA2G2AAKR1B10
SCHEMBL14625187 0.83 PTGDR2 (0.43) PTGDR2PLA2G2AMTNR1AMTNR1BHTR6
SCHEMBL3158280 0.82 HDAC1 (0.42) PTGDR2HDAC1HDAC6AKR1B10AKR1A1
SCHEMBL1886999 0.81 HDAC1 (0.47) PTGDR2HDAC1HDAC6MTNR1AMTNR1B
SCHEMBL12637171 0.81 PTGDR2 (0.49) PTGDR2HDAC1HDAC6MTNR1AMTNR1B
SCHEMBL1871468 0.80 PTGDR2 (0.49) PTGDR2HDAC1HDAC6MTNR1AMTNR1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7935722-B2 Tetrahydrocarbazole derivatives useful as androgen receptor modulators ELI LILLY AND COMPANY (US) 2011-05-03 US disclosed
EP-1902026-B1 TETRAHYDROCARBAZOLE DERIVATIVES USEFUL AS ANDROGEN RECEPTOR MODULATORS (SARM) LILLY CO ELI (US) 2010-02-17 EP disclosed
US-20100022550-A1 TETRAHYDROCARBAZOLE DERIVATIVES USEFUL AS ANDROGEN RECEPTOR MODULATORS CELLECTIS (FR) 2010-01-28 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-20100022550-A1 TETRAHYDROCARBAZOLE DERIVATIVES USEFUL AS ANDROGEN RECEPTOR MODULATORS AR, SHBG, CYP17A1 PTGDR2 437/4885KRAS 4350/4885HDAC1 634/4885

“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.