SCHEMBL2200428

SCHEMBL2200428

c1ccc(-c2ccccc2-c2ccccc2-c2conn2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR55 Q9Y2T6 1/20 0.38
ATR Q13535 1/20 0.37
SMARCA2 P51531 2/20 0.36
SMARCA4 P51532 2/20 0.36
PBRM1 Q86U86 2/20 0.36
TDO2 P48775 1/20 0.36
ABCG2 Q9UNQ0 1/20 0.35
ENPP3 O14638 1/20 0.35
ENPP1 P22413 1/20 0.35
ALDH1A1 P00352 5/20 0.34
NPC1 O15118 3/20 0.34
RAB9A P51151 3/20 0.34
SMN1; SMN2 Q16637 3/20 0.34
HSD17B10 Q99714 2/20 0.34
HPGD P15428 2/20 0.34
MAPK1 P28482 2/20 0.34
BCL2L1 Q07817 1/20 0.34
CYP2A6 P11509 1/20 0.34
NOTUM Q6P988 1/20 0.34
BRD4 O60885 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
SCHEMBL6135309 0.98 GPR55 (0.39) GPR55ATRSMARCA2SMARCA4PBRM1
SCHEMBL58582 0.84 RAB9A (0.36) GPR55SMARCA2SMARCA4PBRM1TDO2
SCHEMBL8998624 0.83 RAB9A (0.39) GPR55SMARCA2SMARCA4PBRM1TDO2
SCHEMBL637900 0.81 RAB9A (0.42) SMARCA2SMARCA4PBRM1ALDH1A1NPC1
SCHEMBL3181328 0.80 SMARCA2 (0.37) GPR55SMARCA2SMARCA4PBRM1TDO2
SCHEMBL28691784 0.79 HPGD (0.38) SMARCA2SMARCA4PBRM1ALDH1A1NPC1
SCHEMBL5014126 0.78 RAB9A (0.44) ENPP3ENPP1ALDH1A1NPC1RAB9A
SCHEMBL6853266 0.77 PTPN5 (0.32) ENPP3ENPP1
SCHEMBL673264 0.76 BCAT2 (0.46) SMARCA2SMARCA4PBRM1ALDH1A1NPC1
SCHEMBL11574702 0.76 NPC1 (0.41) ENPP3ALDH1A1NPC1RAB9ASMN1; SMN2

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-7977670-B2 Organic transistor TOYO INK MFG. CO., LTD. (JP) 2011-07-12 US disclosed
US-20100032657-A1 ORGANIC TRANSISTOR TOYO INK MFG CO., LTD (JP) 2010-02-11 US disclosed
US-20080102311-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT AND ORGANIC ELECTROLUMINESCENT ELEMENT EMPLOYING THE SAME IDEMITSU KOSAN CO., LTD. (JP) 2008-05-01 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-20080102311-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT AND ORGANIC ELECTROLUMINESCENT ELEMENT EMPLOYING THE SAME L1CAM, EML4, EBPL GPR55 4635/4885ATR 1518/4885SMARCA2 1126/4885

“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.