SCHEMBL4921978

SCHEMBL4921978

CCCCCc1c(C)[nH]c2ccccc12

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.70
POLB P06746 1/20 0.70
ALDH1A1 P00352 5/20 0.67
HTT P42858 2/20 0.67
TSHR P16473 2/20 0.67
HTR6 P50406 1/20 0.63
HPGD P15428 3/20 0.59
HSD17B10 Q99714 3/20 0.59
GAA P10253 2/20 0.59
MAPT P10636 3/20 0.59
CYP3A4 P08684 1/20 0.59
PABPC1 P11940 1/20 0.58
ALOX15 P16050 1/20 0.58
CASP1 P29466 1/20 0.54
CASP7 P55210 1/20 0.54
RAB9A P51151 1/20 0.53
CTSV O60911 1/20 0.53
CTSL P07711 1/20 0.53
LMNA P02545 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52

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
SCHEMBL8444672 0.98 KDM4E (0.68) KDM4EPOLBALDH1A1HTTTSHR
SCHEMBL8440798 0.98 KDM4E (0.68) KDM4EPOLBALDH1A1HTTTSHR
SCHEMBL8444727 0.98 KDM4E (0.68) KDM4EPOLBALDH1A1HTTTSHR
SCHEMBL8442541 0.98 KDM4E (0.68) KDM4EPOLBALDH1A1HTTTSHR
SCHEMBL8445695 0.98 KDM4E (0.68) KDM4EPOLBALDH1A1HTTTSHR
SCHEMBL8441371 0.98 KDM4E (0.68) KDM4EPOLBALDH1A1HTTTSHR
SCHEMBL8445875 0.98 KDM4E (0.68) KDM4EPOLBALDH1A1HTTTSHR
SCHEMBL8998008 0.95 KDM4E (0.72) KDM4EPOLBALDH1A1HTTTSHR
SCHEMBL8552151 0.89 ALDH1A1 (0.71) KDM4EPOLBALDH1A1HTTTSHR
SCHEMBL5409935 0.84 CHRNB2 (0.60) KDM4EPOLBALDH1A1HTTTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107501165-B Asymmetric synthesis method of chiral tetrahydrocarbazole derivative 合肥工业大学 2020-03-31 CN disclosed
CN-107501165-A The method of asymmetric synthesis of chiral compounds 合肥工业大学 2017-12-22 CN disclosed
EP-3230463-A1 RAPID PRETREATMENT Sweetwater Energy, Inc. (US) 2017-10-18 EP disclosed
WO-2016094594-A1 RAPID PRETREATMENT SWEETWATER ENERGY, INC. (US) 2016-06-16 WO disclosed
US-20080090871-A1 CANNABIMIMETIC INDOLE DERIVATIVES MAKRIYANNIS ALEXANDROS 2008-04-17 US disclosed
US-7241799-B2 Cannabimimetic indole derivatives UNIVERSITY OF CONNECTICUT (US) 2007-07-10 US disclosed
EP-1702617-A1 Cannabimimetic indole derivatives THE UNIVERSITY OF CONNECTICUT (US) 2006-09-20 EP disclosed
EP-1223929-B1 CANNABIMIMETIC INDOLE DERIVATIVES UNIV CONNECTICUT (US) 2006-08-23 EP disclosed
US-20050119234-A1 Cannabimimetic indole derivatives UNIVERSITY OF CONNECTICUT (US) 2005-06-02 US disclosed
US-6900236-B1 Cannabimimetic indole derivatives UNIVERSITY OF CONNECTICUT (US) 2005-05-31 US disclosed
US-6872835-B2 Process for preparation of fused pyrroles JAPAN SCIENCE & TECHNOLOGY CORPORATION (JP) 2005-03-29 US disclosed
EP-1302459-B1 PROCESSES FOR PREPARATION OF FUSED PYRROLES JAPAN SCIENCE & TECH AGENCY (JP) 2004-10-27 EP disclosed
US-20040049054-A1 Process for preparation of fused pyrroles JAPAN SCIENCE AND TECHNOLOGY CORPORATION (JP) 2004-03-11 US disclosed
EP-1302459-A1 PROCESSES FOR PREPARATION OF FUSED PYRROLES Japan Science and Technology Corporation (JP) 2003-04-16 EP disclosed
US-6433001-B1 SEPTIC SHOCK, ALLERGIC RHINITIS, RHEUMATIC ARTHRITIS, ADULT RESPIRATORY DISTRESS SYNDROME, BRONCHIAL ASTHMA, TRAUMA, AND PANCREATITIS TREATMENT ELI LILLY AND COMPANY 2002-08-13 US disclosed
EP-0675110-B1 1H-Indole-3-glyoxylamide sPLA2 inhibitors LILLY CO ELI (US) 2002-07-10 EP disclosed
US-5919810-A SEPTIC SHOCK ELI LILLY AND COMPANY (US) 1999-07-06 US disclosed
EP-0022634-B1 ACYLATED INDOLE DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS AND DRUGS COMPRISING THEM TEIJIN LIMITED (JP) 1983-04-06 EP disclosed
EP-0022634-A1 Acylated indole derivatives, processes for their preparation and pharmaceutical compositions and drugs comprising them TEIJIN LIMITED (JP) 1981-01-21 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 (3 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-20050119234-A1 Cannabimimetic indole derivatives CNR2, CNR1, HTR2C KDM4E 3392/4885POLB 4672/4885ALDH1A1 3887/4885
US-20040049054-A1 Process for preparation of fused pyrroles IDO1, IDO2, PAH KDM4E 360/4885POLB 1923/4885ALDH1A1 1591/4885
US-20080090871-A1 CANNABIMIMETIC INDOLE DERIVATIVES CNR2, CNR1, GPR34 KDM4E 3526/4885POLB 4412/4885ALDH1A1 3604/4885

“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.