SCHEMBL6771697

SCHEMBL6771697

COc1ccc(F)c(NC(=O)c2c[nH]c3c2C(=O)CC(C)(C)C3)c1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 3/20 0.44
TP53 P04637 2/20 0.44
SMN1; SMN2 Q16637 4/20 0.42
PTGS1 P23219 2/20 0.41
PTGS2 P35354 2/20 0.41
BUB1 O43683 4/20 0.41
ALPL P05186 1/20 0.40
GPR35 Q9HC97 1/20 0.38
RAB9A P51151 4/20 0.38
NPC1 O15118 2/20 0.38
GAA P10253 1/20 0.38
EHMT2 Q96KQ7 2/20 0.38
MAPK14 Q16539 1/20 0.37
MEN1 O00255 1/20 0.36
MAPT P10636 1/20 0.36
KMT2A Q03164 1/20 0.36

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
SCHEMBL6768158 0.92 SMN1; SMN2 (0.45) RXFP1TP53SMN1; SMN2PTGS1PTGS2
SCHEMBL6771454 0.87 RXFP1 (0.45) RXFP1TP53SMN1; SMN2PTGS1PTGS2
SCHEMBL7398344 0.84 DHODH (0.40) TP53SMN1; SMN2GPR35RAB9ANPC1
SCHEMBL7358902 0.84 TP53 (0.40) TP53SMN1; SMN2GPR35RAB9ANPC1
SCHEMBL7392152 0.83 ROCK2 (0.47) TP53SMN1; SMN2GPR35RAB9ANPC1
SCHEMBL6771471 0.83 EHMT2 (0.49) RXFP1TP53SMN1; SMN2BUB1ALPL
SCHEMBL6778444 0.83 LMNA (0.52) RXFP1TP53SMN1; SMN2BUB1RAB9A
SCHEMBL6772558 0.82 MAPT (0.48) RXFP1TP53SMN1; SMN2RAB9ANPC1
SCHEMBL6774119 0.82 EHMT2 (0.51) RXFP1TP53SMN1; SMN2BUB1RAB9A
SCHEMBL6776660 0.82 MAPT (0.40) RXFP1TP53SMN1; SMN2BUB1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6720339-B2 SUCH AS N-PHENYL-4-OXO-6,6-DIMETHYL-4,5,6,7-TETRAHYDRO-1H-INDOLE-3-CARBOXAMIDE; FOR DIAGNOSIS AND TREATMENT OF ANXIETY, SLEEP AND SEIZURE DISORDERS, OVERDOSE WITH BENZODIAZEPINE DRUGS, AND FOR MEMORY ENHANCEMENT NEUROGEN CORPORATION 2004-04-13 US claimed
US-20020198204-A1 Such as n-phenyl-4-oxo-6,6-dimethyl-4,5,6,7-tetrahydro-1H-indole-3-carboxamide; for diagnosis and treatment of anxiety, sleep and seizure disorders, overdose with benzodiazepine drugs, and for memory enhancement NEUROGEN CORPORATION, A CORPORATION OF THE STATE OF DELAWARE 2002-12-26 US claimed
US-6353109-B2 PSYCHOLOGICAL DISORDERS; SLEEP DISORDERS; ANTICONVULSANTS; COGNITION ACTIVATORS NEUROGEN CORPORATION 2002-03-05 US claimed
US-20010020035-A1 Psychological disorders; sleep disorders; anticonvulsants; cognition activators ALBAUGH PAMELA (US) 2001-09-06 US claimed
US-6720339-B2 SUCH AS N-PHENYL-4-OXO-6,6-DIMETHYL-4,5,6,7-TETRAHYDRO-1H-INDOLE-3-CARBOXAMIDE; FOR DIAGNOSIS AND TREATMENT OF ANXIETY, SLEEP AND SEIZURE DISORDERS, OVERDOSE WITH BENZODIAZEPINE DRUGS, AND FOR MEMORY ENHANCEMENT NEUROGEN CORPORATION 2004-04-13 US disclosed
US-20020198204-A1 Such as n-phenyl-4-oxo-6,6-dimethyl-4,5,6,7-tetrahydro-1H-indole-3-carboxamide; for diagnosis and treatment of anxiety, sleep and seizure disorders, overdose with benzodiazepine drugs, and for memory enhancement NEUROGEN CORPORATION, A CORPORATION OF THE STATE OF DELAWARE 2002-12-26 US disclosed
US-6353109-B2 PSYCHOLOGICAL DISORDERS; SLEEP DISORDERS; ANTICONVULSANTS; COGNITION ACTIVATORS NEUROGEN CORPORATION 2002-03-05 US disclosed
US-20010020035-A1 Psychological disorders; sleep disorders; anticonvulsants; cognition activators ALBAUGH PAMELA (US) 2001-09-06 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 (2 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-20010020035-A1 Psychological disorders; sleep disorders; anticonvulsants; cognition activators GABRA1, GABRA4, GABRA2 RXFP1 278/4885TP53 4708/4885SMN1; SMN2 1796/4885
US-20020198204-A1 Such as n-phenyl-4-oxo-6,6-dimethyl-4,5,6,7-tetrahydro-1H-indole-3-carboxamide; for diagnosis and treatment of anxiety, sleep and seizure disorders, overdose with benzodiazepine drugs, and for memory enhancement CNR1, HTR1A, GABRA6 RXFP1 207/4885TP53 4834/4885SMN1; SMN2 990/4885

“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.