SCHEMBL3365242

SCHEMBL3365242

CN(C)c1cccc2c1CCCC2

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 2/20 0.50
RXRB P28702 2/20 0.50
RXRG P48443 2/20 0.50
BCL2L1 Q07817 1/20 0.50
BAD Q92934 1/20 0.50
TSHR P16473 1/20 0.42
KDM4E B2RXH2 1/20 0.40
GAA P10253 1/20 0.40
MAPT P10636 1/20 0.40
DHFR P00374 1/20 0.40
ALDH1A1 P00352 3/20 0.39
MEN1 O00255 1/20 0.38
LMNA P02545 1/20 0.38
THRA P10827 1/20 0.38
THRB P10828 1/20 0.38
KMT2A Q03164 1/20 0.38
NLRP3 Q96P20 1/20 0.36
HTT P42858 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36

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
SCHEMBL15465888 0.96 RXRA (0.50) RXRARXRBRXRGBCL2L1BAD
SCHEMBL19697741 0.79 RXRA (0.47) RXRARXRBRXRGBCL2L1BAD
SCHEMBL9092770 0.78 RXRA (0.53) RXRARXRBRXRGBCL2L1BAD
SCHEMBL8384554 0.75 BCL2L1 (0.46) RXRARXRBRXRGBCL2L1BAD
SCHEMBL16559080 0.75 RXRA (0.47) RXRARXRBRXRGBCL2L1BAD
SCHEMBL22705239 0.74 RXRA (0.47) RXRARXRBRXRGBCL2L1BAD
SCHEMBL13868391 0.74 ALDH1A1 (0.44) RXRARXRBRXRGBCL2L1BAD
Ammonia Solution, Strong SCHEMBL28512747 0.74 MAPT (0.43) TSHRKDM4EGAAMAPTALDH1A1
SCHEMBL7725810 0.73 RXRA (0.46) RXRARXRBRXRGBCL2L1BAD
SCHEMBL11775628 0.73 RXRA (0.49) RXRARXRBRXRGBCL2L1BAD

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-10043978-B2 Organic semiconductor formulations FLEXTERRA, INC. (US) 2018-08-07 US disclosed
US-20170012208-A1 ORGANIC SEMICONDUCTOR FORMULATIONS USINVEST LLC 2017-01-12 US disclosed
US-9293711-B2 Organic semiconductor formulations POLYERA CORPORATION (US) 2016-03-22 US disclosed
US-20140042369-A1 Organic Semiconductor Formulations USINVEST LLC 2014-02-13 US disclosed
US-20100009970-A1 COMPOSITIONS AND METHODS FOR TREATMENT OF VIRAL DISEASES COMBINATORX (SINGAPORE) PTE. LTD. (SG) 2010-01-14 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-20100009970-A1 COMPOSITIONS AND METHODS FOR TREATMENT OF VIRAL DISEASES HTR1A, HTR3B, HTR3A RXRA 4103/4885RXRB 3997/4885RXRG 4189/4885

“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.