SCHEMBL3654076

SCHEMBL3654076

CC1(C)[C@@H]2CC[C@@H](CO)[C@@H]1C2

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RET P07949 1/20 0.53
MAPK14 Q16539 1/20 0.53
CAMK1D Q8IU85 1/20 0.53
HDAC6 Q9UBN7 3/20 0.40
ALOX15 P16050 1/20 0.39
EPHX2 P34913 1/20 0.39
CXCR3 P49682 2/20 0.38
TBXA2R P21731 2/20 0.38
S1PR1 P21453 1/20 0.36
CNR1 P21554 1/20 0.35
SCN9A Q15858 5/20 0.35
SCN5A Q14524 1/20 0.35
HSD11B1 P28845 1/20 0.34
OPRM1 P35372 1/20 0.34
OPRK1 P41145 1/20 0.34
OPRL1 P41146 1/20 0.34

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
SCHEMBL20451368 1.00 RET (0.53) RETMAPK14CAMK1DHDAC6ALOX15
SCHEMBL3653711 1.00 RET (0.53) RETMAPK14CAMK1DHDAC6ALOX15
SCHEMBL14452951 1.00 RET (0.53) RETMAPK14CAMK1DHDAC6ALOX15
SCHEMBL31089443 1.00 RET (0.53) RETMAPK14CAMK1DHDAC6ALOX15
SCHEMBL31509006 1.00 RET (0.53) RETMAPK14CAMK1DHDAC6ALOX15
SCHEMBL3653708 1.00 RET (0.53) RETMAPK14CAMK1DHDAC6ALOX15
SCHEMBL8991540 1.00 RET (0.53) RETMAPK14CAMK1DHDAC6ALOX15
SCHEMBL596246 1.00 RET (0.53) RETMAPK14CAMK1DHDAC6ALOX15
SCHEMBL3651148 1.00 RET (0.53) RETMAPK14CAMK1DHDAC6ALOX15
SCHEMBL8991537 1.00 RET (0.53) RETMAPK14CAMK1DHDAC6ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2207766-A1 NOVEL SULFAMATE COMPOUNDS FOR MEDICAL USE Abbott Products GmbH (DE) 2010-07-21 EP claimed
US-20090104126-A1 Sulfamate Compounds and Uses Thereof SOLVAY PHARMACEUTICALS GMBH (DE) 2009-04-23 US claimed
WO-2009050252-A1 NOVEL SULFAMATE COMPOUNDS FOR MEDICAL USE SOLVAY PHARMACEUTICALS GMBH (DE) 2009-04-23 WO claimed
US-20210346369-A1 APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE AND AUTOIMMUNE DISEASES ABBVIE INC. (US) 2021-11-11 US disclosed
US-20200345717-A1 APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE AND AUTOIMMUNE DISEASES ABBVIE INC. (US) 2020-11-05 US disclosed
EP-2768830-B1 APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE AND AUTOIMMUNE DISEASES ABBVIE INC (US) 2018-08-29 EP disclosed
US-20180221363-A1 APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE AND AUTOIMMUNE DISEASES ABBVIE INC (US) 2018-08-09 US disclosed
US-9877958-B2 Apoptosis-induced agents for the treatment of cancer and immune and autoimmune diseases ABBVIE INC. (US) 2018-01-30 US disclosed
EP-3266776-A1 APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE AND AUTOIMMUNE DISEASES AbbVie Inc. (US) 2018-01-10 EP disclosed
US-20160206611-A1 APOPTOSIS-INDUCED AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE AND AUTOIMMUNE DISEASES ABBVIE INC (US) 2016-07-21 US disclosed
US-9266877-B2 Apoptosis-inducing agents for the treatment of cancer and immune and autoimmune diseases ABBVIE INC. (US) 2016-02-23 US disclosed
US-20150152097-A1 APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE AND AUTOIMMUNE DISEASES ABBVIE INC (US) 2015-06-04 US disclosed
US-8940737-B2 Apoptosis-inducing agents for the treatment of cancer and immune and autoimmune diseases ABBVIE INC. (US) 2015-01-27 US disclosed
US-20130096121-A1 APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE AND AUTOIMMUNE DISEASES ABBVIE INC. (US) 2013-04-18 US disclosed
EP-2207766-A1 NOVEL SULFAMATE COMPOUNDS FOR MEDICAL USE Abbott Products GmbH (DE) 2010-07-21 EP disclosed
WO-2009050252-A1 NOVEL SULFAMATE COMPOUNDS FOR MEDICAL USE SOLVAY PHARMACEUTICALS GMBH (DE) 2009-04-23 WO disclosed
US-20090104126-A1 Sulfamate Compounds and Uses Thereof SOLVAY PHARMACEUTICALS GMBH (DE) 2009-04-23 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 (7 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-20200345717-A1 APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE AND AUTOIMMUNE DISEASES BAX, BCL2, BCL3 RET 3964/4885MAPK14 1372/4885CAMK1D 593/4885
US-20210346369-A1 APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE AND AUTOIMMUNE DISEASES BAX, BCL2, BCL3 RET 3964/4885MAPK14 1372/4885CAMK1D 593/4885
US-20180221363-A1 APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE AND AUTOIMMUNE DISEASES BAX, BCL2, BCL3 RET 3964/4885MAPK14 1372/4885CAMK1D 593/4885
US-20130096121-A1 APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE AND AUTOIMMUNE DISEASES BCL2A1, BCL2L1, BCL2L11 RET 4600/4885MAPK14 2034/4885CAMK1D 2032/4885
US-20160206611-A1 APOPTOSIS-INDUCED AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE AND AUTOIMMUNE DISEASES BAX, BCL2, BCL3 RET 3982/4885MAPK14 1357/4885CAMK1D 640/4885
US-20090104126-A1 Sulfamate Compounds and Uses Thereof SULT1A1, SULT1E1, SULT2A1 RET 555/4885MAPK14 3761/4885CAMK1D 4417/4885
US-20150152097-A1 APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE AND AUTOIMMUNE DISEASES BAX, BCL2, BCL3 RET 3964/4885MAPK14 1372/4885CAMK1D 593/4885

“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.