SCHEMBL15840241

SCHEMBL15840241

CC(C)(C)c1ccc2c(c1)C1(c3cc(C(C)(C)C)ccc3-2)c2ccccc2-c2c1ccc1c2[nH]c2ccccc21

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 12/20 0.50
PGR P06401 1/20 0.37
MAOA P21397 1/20 0.36
PARP14 Q460N5 2/20 0.35
CDK4 P11802 1/20 0.35
CCND1 P24385 1/20 0.35
GABRP O00591 1/20 0.34
GABRD O14764 1/20 0.34
GABRA1 P14867 1/20 0.34
GABRB1 P18505 1/20 0.34
GABRG2 P18507 1/20 0.34
GABRB3 P28472 1/20 0.34
GABRA5 P31644 1/20 0.34
GABRA3 P34903 1/20 0.34
GABRA2 P47869 1/20 0.34
GABRB2 P47870 1/20 0.34
GABRA4 P48169 1/20 0.34
GABRE P78334 1/20 0.34
GABRA6 Q16445 1/20 0.34
GABRG1 Q8N1C3 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
SCHEMBL15840228 0.91 KIF11 (0.49) KIF11PGRCDK4CCND1GABRA1
SCHEMBL29506370 0.86 KIF11 (0.45) KIF11PGRMAOAPARP14CDK4
SCHEMBL31632211 0.86 KIF11 (0.45) KIF11PGRMAOAPARP14CDK4
SCHEMBL15824466 0.86 KIF11 (0.45) KIF11PGRMAOAPARP14CDK4
SCHEMBL20199544 0.85 KIF11 (0.44) KIF11PGRMAOAPARP14CDK4
SCHEMBL15840146 0.85 KIF11 (0.46) KIF11PGRMAOAPARP14CDK4
SCHEMBL15840202 0.83 PDK2 (0.39) KIF11PGRMAOAPARP14GABRP
SCHEMBL15840203 0.83 PDK2 (0.39) KIF11PGRMAOAPARP14GABRP
SCHEMBL22133797 0.81 KIF11 (0.44) KIF11PGRMAOAPARP14CDK4
SCHEMBL24730283 0.78 CDK4 (0.46) KIF11PGRMAOAPARP14CDK4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10227528-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2019-03-12 US disclosed
EP-2935276-B1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2017-11-01 EP disclosed
US-20150337197-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2015-11-26 US disclosed
US-20150337197-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2015-11-26 US disclosed
WO-2014094963-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2014-06-26 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-10227528-B2 Materials for organic electroluminescent devices OR10J3, EPCAM, L1CAM KIF11 2789/4885PGR 2357/4885MAOA 399/4885
US-20150337197-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES OR10J3, EML4, L1CAM KIF11 3374/4885PGR 2243/4885MAOA 320/4885

“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.