SCHEMBL6942300

SCHEMBL6942300

CC1=CC(=O)CC2CCc3cc(Cl)ccc3N12

nearest known ligand 0.59

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 3/20 0.59
SRD5A1 P18405 15/20 0.57
HTR2C P28335 1/20 0.41
HTR2B P41595 1/20 0.41
HSD17B3 P37058 1/20 0.41

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
SCHEMBL6943997 0.73 SRD5A1 (1.00) NOTUMSRD5A1HTR2CHTR2BHSD17B3
SCHEMBL6823141 0.72 SRD5A1 (1.00) NOTUMSRD5A1HSD17B3
SCHEMBL6946819 0.69 HTR2C (0.56) NOTUMSRD5A1HTR2CHTR2B
SCHEMBL6820051 0.67 SRD5A1 (0.64) NOTUMSRD5A1
SCHEMBL4713862 0.65 NOTUM (0.62) NOTUMSRD5A1HTR2CHTR2B
SCHEMBL8858028 0.64 HTR2C (0.51) NOTUMSRD5A1HTR2CHTR2BHSD17B3
SCHEMBL15964553 0.64 AADAT (0.50) NOTUMSRD5A1
SCHEMBL20344483 0.64 SRD5A1 (0.50) NOTUMSRD5A1
SCHEMBL7051403 0.63 SRD5A1 (1.00) NOTUMSRD5A1HSD17B3
SCHEMBL6944630 0.63 SRD5A1 (1.00) NOTUMSRD5A1HSD17B3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6555549-B2 Useful in treating acne, baldness, prostatic cancer and hypertrophy in men and hirsutism in women APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. (NL) 2003-04-29 US claimed
EP-0999747-B1 USE OF BENZO[C]QUINOLIZINE DERIVATIVES AS PLANT GROWTH REGULATORS APPLIED RESEARCH SYSTEMS (AN) 2003-04-23 EP claimed
EP-0880520-B1 BENZO [C]QUINOLIZINE DERIVATIVES, THEIR PREPARATION AND USE AS 5-ALPHA-REDUCTASES INHIBITORS APPLIED RESEARCH SYSTEMS (AN) 2003-04-16 EP claimed
US-6514912-B1 Use of benzo[C]quinolizine derivatives as plant growth regulators APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. (AN) 2003-02-04 US claimed
US-20010047098-A1 Benzo[c]quinolizine derivatives, their preparation and use as 5alpha-reductases inhibitors MERCK SERONO SA (CH) 2001-11-29 US claimed
US-20010044542-A1 Benzo [c] quinolizine derivatives, their preparation and use as 5alpha-reductases inhibitors MERCK SERONO SA (CH) 2001-11-22 US claimed
EP-0999747-A1 USE OF BENZO C]QUINOLIZINE DERIVATIVES AS PLANT GROWTH REGULATORS Applied Research Systems ARS Holding N.V. (AN) 2000-05-17 EP claimed
WO-1999005913-A1 USE OF BENZO[C]QUINOLIZINE DERIVATIVES AS PLANT GROWTH REGULATORS APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. (AN) 1999-02-11 WO claimed
US-6555549-B2 Useful in treating acne, baldness, prostatic cancer and hypertrophy in men and hirsutism in women APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. (NL) 2003-04-29 US disclosed
EP-0999747-B1 USE OF BENZO[C]QUINOLIZINE DERIVATIVES AS PLANT GROWTH REGULATORS APPLIED RESEARCH SYSTEMS (AN) 2003-04-23 EP disclosed
US-6552034-B2 Cyclization of a silylated butadiene reacted with a 2-oxo-1,2,3,4-tetrahydroquinoline; acne; alopecia; prostatic cancer and hypertrophy; hirsutism in women; skin and glandular disorders; anticarcinogenic agents APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. (NL) 2003-04-22 US disclosed
EP-0880520-B1 BENZO [C]QUINOLIZINE DERIVATIVES, THEIR PREPARATION AND USE AS 5-ALPHA-REDUCTASES INHIBITORS APPLIED RESEARCH SYSTEMS (AN) 2003-04-16 EP disclosed
US-6514912-B1 Use of benzo[C]quinolizine derivatives as plant growth regulators APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. (AN) 2003-02-04 US disclosed
US-20010047098-A1 Benzo[c]quinolizine derivatives, their preparation and use as 5alpha-reductases inhibitors MERCK SERONO SA (CH) 2001-11-29 US disclosed
US-20010044542-A1 Benzo [c] quinolizine derivatives, their preparation and use as 5alpha-reductases inhibitors MERCK SERONO SA (CH) 2001-11-22 US disclosed
US-6303622-B1 FOR THERAPY OF ACNE, BALDNESS, PROSTATE CANCER, PROSTATIC HYPERTROPHY; HIRSUTISM APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. (NL) 2001-10-16 US disclosed
EP-0999747-A1 USE OF BENZO C]QUINOLIZINE DERIVATIVES AS PLANT GROWTH REGULATORS Applied Research Systems ARS Holding N.V. (AN) 2000-05-17 EP disclosed
WO-1999005913-A1 USE OF BENZO[C]QUINOLIZINE DERIVATIVES AS PLANT GROWTH REGULATORS APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. (AN) 1999-02-11 WO 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-20010044542-A1 Benzo [c] quinolizine derivatives, their preparation and use as 5alpha-reductases inhibitors CYP3A5, CYP51A1, CYP2F1 NOTUM 551/4885SRD5A1 8/4885HTR2C 531/4885
US-20010047098-A1 Benzo[c]quinolizine derivatives, their preparation and use as 5alpha-reductases inhibitors CYP3A5, CYP51A1, CYP2F1 NOTUM 551/4885SRD5A1 8/4885HTR2C 531/4885

“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.