SCHEMBL6691603

SCHEMBL6691603

c1ccc2c(c1)CCNC2c1cc2ccccc2[nH]1

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PRCP P42785 8/20 0.53
GAA P10253 1/20 0.51
RECQL P46063 1/20 0.51
GID4 Q8IVV7 1/20 0.44
MAPT P10636 1/20 0.42
SLC22A1 O15245 1/20 0.41
TSHR P16473 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
DRD1 P21728 1/20 0.40
MAOA P21397 1/20 0.39
ALDH1A1 P00352 1/20 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
SCHEMBL28750379 0.77 ADRA1A (0.43) GID4ALDH1A1
SCHEMBL6412287 0.75 SLC6A3 (0.39)
SCHEMBL7481839 0.73 FLT3 (0.37) MAPT
SCHEMBL30833186 0.72 HTR7 (0.63) ALDH1A1
SCHEMBL1597975 0.72 KDM1A (0.69) PRCPGAARECQLGID4TSHR
SCHEMBL7697942 0.72 PRCP (0.54) PRCPGAARECQLGID4MAPT
SCHEMBL7697938 0.72 PRCP (0.54) PRCPGAARECQLGID4MAPT
SCHEMBL2676256 0.71 PRCP (0.59) PRCPGAARECQLGID4MAPT
SCHEMBL28547431 0.70 PRCP (0.53) PRCPGAARECQLGID4MAPT
SCHEMBL12046710 0.70 PRCP (1.00) PRCPGAARECQLGID4SLC22A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116041319-B Preparation method of indolyl tetrahydroisoquinoline derivative 江苏中利集团股份有限公司 2023-08-25 CN claimed
CN-116041319-A Preparation method of indolyl tetrahydroisoquinoline derivative 江苏中利集团股份有限公司 2023-05-02 CN claimed
WO-2004082686-A2 USE OF COMPOUNDS WITH COMBINED 5-HT1A AND SSRI ACTIVITIES TO TREAT SEXUAL DYSFUNCTION DYNOGEN PHARMACEUTICALS, INC. (US) 2004-09-30 WO claimed
US-20040192730-A1 Methods of using compounds with combined 5-HT1A and SSRI activities as-needed to treat sexual dysfunction DYNOGEN PHARMACEUTICALS, INC. (US) 2004-09-30 US claimed
CN-116041319-B Preparation method of indolyl tetrahydroisoquinoline derivative 江苏中利集团股份有限公司 2023-08-25 CN disclosed
CN-116041319-B Preparation method of indolyl tetrahydroisoquinoline derivative 江苏中利集团股份有限公司 2023-08-25 CN disclosed
CN-116041319-B Preparation method of indolyl tetrahydroisoquinoline derivative 江苏中利集团股份有限公司 2023-08-25 CN disclosed
CN-116041319-A Preparation method of indolyl tetrahydroisoquinoline derivative 江苏中利集团股份有限公司 2023-05-02 CN disclosed
CN-116041319-A Preparation method of indolyl tetrahydroisoquinoline derivative 江苏中利集团股份有限公司 2023-05-02 CN disclosed
CN-116041319-A Preparation method of indolyl tetrahydroisoquinoline derivative 江苏中利集团股份有限公司 2023-05-02 CN disclosed
WO-2004082686-A2 USE OF COMPOUNDS WITH COMBINED 5-HT1A AND SSRI ACTIVITIES TO TREAT SEXUAL DYSFUNCTION DYNOGEN PHARMACEUTICALS, INC. (US) 2004-09-30 WO disclosed
US-20040192730-A1 Methods of using compounds with combined 5-HT1A and SSRI activities as-needed to treat sexual dysfunction DYNOGEN PHARMACEUTICALS, INC. (US) 2004-09-30 US disclosed
CN-1348450-A Tetrahydroisoquinolinyl-indole derivatives for the treatment of depression AMERICAN HOME PROD (US) 2002-05-08 CN disclosed
US-6245780-B1 PSYCHOLOGICAL DISORDERS AMERICAN HOME PRODUCTS CORP 2001-06-12 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-20040192730-A1 Methods of using compounds with combined 5-HT1A and SSRI activities as-needed to treat sexual dysfunction HTR5A, HTR1A, HTR3A PRCP 817/4885GAA 1474/4885RECQL 3260/4885

“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.