SCHEMBL20935874

SCHEMBL20935874

CCC(C)(C)c1cccc2c1sc1ccccc12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR3 P46089 1/20 0.42
RAB9A P51151 5/20 0.41
MAPT P10636 5/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
ALDH1A1 P00352 3/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
KDM4E B2RXH2 2/20 0.40
ATM Q13315 1/20 0.40
PARP14 Q460N5 1/20 0.38
ALOX5 P09917 1/20 0.38
HPGD P15428 2/20 0.35
NPC1 O15118 1/20 0.35
LMNA P02545 1/20 0.35
GLA P06280 1/20 0.35
ALOX15 P16050 1/20 0.35
TSHR P16473 1/20 0.35
ALOX12 P18054 1/20 0.35
TNKS O95271 2/20 0.34
TNKS2 Q9H2K2 2/20 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
SCHEMBL26166001 0.88 PARP14 (0.47) GPR3RAB9AMAPTMEN1KMT2A
SCHEMBL26362310 0.86 CA2 (0.36) ALDH1A1TSHRKIF11TDP1
SCHEMBL12395340 0.84 GPR3 (0.50) GPR3RAB9AMAPTMEN1KMT2A
SCHEMBL2386758 0.81 GPR3 (0.43) GPR3RAB9AMAPTMEN1KMT2A
SCHEMBL25943138 0.81 PARP14 (0.33) PARP14ALOX5
SCHEMBL23920350 0.80 PRNP (0.33) RAB9AMAPTMEN1KMT2AALDH1A1
SCHEMBL25003880 0.80 PARP14 (0.48) GPR3RAB9AMAPTMEN1KMT2A
SCHEMBL24272479 0.79 RAB9A (0.38) RAB9AMAPTMEN1KMT2AALDH1A1
SCHEMBL24634343 0.77 LPL (0.35) GPR3CASP3
SCHEMBL30399934 0.75 GPR3 (0.48) GPR3RAB9AMAPTMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190123284-A1 POLYHETEROAROMATIC COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE USING THE SAME LUMINESCENCE TECHNOLOGY CORPORATION (TW) 2019-04-25 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 (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-20190123284-A1 POLYHETEROAROMATIC COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE USING THE SAME DDT, ALKBH1, PPOX GPR3 3915/4885RAB9A 3957/4885MAPT 1823/4885

“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.