SCHEMBL16149704

SCHEMBL16149704

CC=CC=CC=CCCCCC=CCCC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.50
TSHR P16473 1/20 0.50
SOAT1 P35610 1/20 0.41
FASN P49327 1/20 0.39
FAAH O00519 4/20 0.38
TRPV1 Q8NER1 2/20 0.38
CNR1 P21554 1/20 0.34
CNR2 P34972 1/20 0.34
GMNN O75496 1/20 0.33
USP2 O75604 1/20 0.33
LMNA P02545 1/20 0.33
CYP1A2 P05177 1/20 0.33
POLB P06746 1/20 0.33
MAPT P10636 1/20 0.33
CYP2C9 P11712 1/20 0.33
ALOX15 P16050 1/20 0.33
APEX1 P27695 1/20 0.33
CYP2C19 P33261 1/20 0.33
RECQL P46063 1/20 0.33
BLM P54132 1/20 0.33

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
SCHEMBL16149703 1.00 ALDH1A1 (0.50) ALDH1A1TSHRSOAT1FASNFAAH
SCHEMBL9492045 0.93 ALDH1A1 (0.41) ALDH1A1TSHRSOAT1FASNFAAH
SCHEMBL9492047 0.93 ALDH1A1 (0.41) ALDH1A1TSHRSOAT1FASNFAAH
SCHEMBL732602 0.90 ALDH1A1 (0.41) ALDH1A1TSHRSOAT1FASNTRPV1
SCHEMBL20372249 0.90 ALDH1A1 (0.41) ALDH1A1TSHRSOAT1FASNTRPV1
SCHEMBL10282163 0.90 ALDH1A1 (0.41) ALDH1A1TSHRSOAT1FASNTRPV1
SCHEMBL732601 0.90 ALDH1A1 (0.41) ALDH1A1TSHRSOAT1FASNTRPV1
SCHEMBL2915027 0.88 ALDH1A1 (0.64) ALDH1A1TSHRSOAT1FASNFAAH
SCHEMBL2915024 0.88 ALDH1A1 (0.64) ALDH1A1TSHRSOAT1FASNFAAH
SCHEMBL14968886 0.88 ALDH1A1 (0.64) ALDH1A1TSHRSOAT1FASNFAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9745266-B2 Indoline alkaloid compounds THE REGENTS OF THE UNIVERSITY OF COLORADO (US) 2017-08-29 US disclosed
US-20160060219-A1 INDOLINE ALKALOID COMPOUNDS THE REGENTS OF THE UNIVERSITY OF COLORADO, A BODY CORPORATE (US) 2016-03-03 US disclosed
WO-2014165548-A2 INDOLINE ALKALOID COMPOUNDS THE REGENTS OF THE UNIVERISITY OF COLORADO, A BODY CORPORATE (US) 2014-10-09 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 (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-20160060219-A1 INDOLINE ALKALOID COMPOUNDS INMT, IDO1, SRM ALDH1A1 2629/4885TSHR 3843/4885SOAT1 2160/4885

“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.