SCHEMBL5656883

SCHEMBL5656883

c1cc2ccn3ccc(c1)c23

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.35
ALDH1A1 P00352 1/20 0.35
CYP1A1 P04798 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
HPGD P15428 1/20 0.35
TSHR P16473 1/20 0.35
CYP1B1 Q16678 1/20 0.35
HSD17B10 Q99714 1/20 0.35
PARP1 P09874 1/20 0.34
CDK4 P11802 4/20 0.33
CCND1 P24385 4/20 0.33
CYP2A6 P11509 1/20 0.33
ALOX12 P18054 1/20 0.33
ERCC1 P07992 1/20 0.31
FEN1 P39748 1/20 0.31
ERCC4 Q92889 1/20 0.31
HTR2A P28223 2/20 0.31
HTR2C P28335 1/20 0.31

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
SCHEMBL4502403 0.84 ALDH1A1 (0.48) IDO1ALDH1A1CYP1A1CYP1A2CYP3A4
SCHEMBL15263672 0.77 PAX8 (0.39) IDO1ALDH1A1CYP1A2PARP1CYP2A6
SCHEMBL16523549 0.69
SCHEMBL25045527 0.64
SCHEMBL24701710 0.63 ADRA2A (0.39) ALDH1A1CYP1A2TSHRCYP2A6
SCHEMBL15984630 0.61 ALDH1A1 (0.40) ALDH1A1CYP1A1CYP1A2CYP3A4HPGD
SCHEMBL25044247 0.57 ALOX15 (0.36)
Naphthalene SCHEMBL1331142 0.53 CYP2A6 (1.00) ALDH1A1CYP1A1CYP1A2CYP3A4HPGD
Naphthalene SCHEMBL1330659 0.53 CYP2A6 (1.00) ALDH1A1CYP1A1CYP1A2CYP3A4HPGD
Naphthalene SCHEMBL1332240 0.53 CYP2A6 (1.00) ALDH1A1CYP1A1CYP1A2CYP3A4HPGD

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 30 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1348454-A Tetracyclic azepinoindole compounds as 5-HT receptor ligands UPJOHN CO (US) 2002-05-08 CN claimed
EP-0145591-B1 PYRROLO(3,2,1-HI)INDOLE DERIVATIVES, THEIR PREPARATION AND THEIR THERAPEUTICAL USE SYNTHELABO (FR) 1988-06-22 EP claimed
US-11697653-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2023-07-11 US disclosed
US-20070105908-A1 Thiazolimine compound and oxazolimine compound DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2007-05-10 US disclosed
CN-1768745-A Medicine for improving excretion capacity of bladder TAKEDA PHARMACEUTICAL (JP) 2006-05-10 CN disclosed
EP-1640369-A1 THIAZOLIMINE COMPOUND AND OXAZOLIMINE COMPOUND Dainippon Sumitomo Pharma Co., Ltd. (JP) 2006-03-29 EP disclosed
US-6867198-B2 Agents and methods for the treatment of proliferative diseases ELI LILLY AND COMPANY (US) 2005-03-15 US disclosed
CN-1589153-A Prevention or treatment of urinary disorders TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2005-03-02 CN disclosed
CN-1572299-A Medicine for improving excretion capacity of bladder TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2005-02-02 CN disclosed
EP-1500643-A1 BENZAMIDE DERIVATIVES SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2005-01-26 EP disclosed
CN-1183132-C Tetracyclic azepinoindole compounds as 5-HT receptor ligands �������Ŷ���Լ��������˾ 2005-01-05 CN disclosed
CN-1348454-A Tetracyclic azepinoindole compounds as 5-HT receptor ligands UPJOHN CO (US) 2002-05-08 CN disclosed
CN-1328451-A Medicine for improving excretion capacity of bladder TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2001-12-26 CN disclosed
EP-0311467-B1 Use of pyrrolo[3,2,1-hi]indole derivatives in the manufacture of a medicament for the treatment of diabetes SYNTHELABO (FR) 1993-08-04 EP disclosed
EP-0311467-A2 Use of pyrrolo[3,2,1-hi]indole derivatives in the manufacture of a medicament for the treatment of diabetes SYNTHELABO (FR) 1989-04-12 EP disclosed
EP-0311467-A2 Use of pyrrolo[3,2,1-hi]indole derivatives in the manufacture of a medicament for the treatment of diabetes SYNTHELABO (FR) 1989-04-12 EP disclosed
EP-0145591-B1 PYRROLO(3,2,1-HI)INDOLE DERIVATIVES, THEIR PREPARATION AND THEIR THERAPEUTICAL USE SYNTHELABO (FR) 1988-06-22 EP disclosed
US-4617313-A ANTIDEPRESSANTS SYNTHELABO (FR) 1986-10-14 US disclosed
US-4617313-A ANTIDEPRESSANTS SYNTHELABO (FR) 1986-10-14 US disclosed
EP-0145591-A2 Pyrrolo(3,2,1-hi)indole derivatives, their preparation and their therapeutical use SYNTHELABO (FR) 1985-06-19 EP 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-11697653-B2 Organic electroluminescent materials and devices L1CAM, SOD1, EPCAM IDO1 3966/4885ALDH1A1 380/4885CYP1A1 1562/4885
US-20070105908-A1 Thiazolimine compound and oxazolimine compound CMA1, TH, NPR3 IDO1 117/4885ALDH1A1 1307/4885CYP1A1 185/4885

“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.