SCHEMBL239338

SCHEMBL239338

c1ccc(C2(c3ccccc3)CC[N]CC2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 4/20 0.54
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
CYP2C9 P11712 1/20 0.52
GRIN2D O15399 1/20 0.45
GRIN3B O60391 1/20 0.45
CHRM2 P08172 1/20 0.45
CHRM1 P11229 1/20 0.45
GRIN1 Q05586 1/20 0.45
KCNH2 Q12809 1/20 0.45
GRIN2A Q12879 1/20 0.45
GRIN2B Q13224 1/20 0.45
GRIN2C Q14957 1/20 0.45
GRIN3A Q8TCU5 1/20 0.45
CYP2D6 P10635 1/20 0.45
HTR2A P28223 1/20 0.45
DRD4 P21917 1/20 0.42
OPRK1 P41145 1/20 0.39
OPRL1 P41146 1/20 0.39
AKT2 P31751 1/20 0.39

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
SCHEMBL6998958 0.83 OPRM1 (0.56) OPRM1MEN1KMT2ACYP2C9CYP2D6
SCHEMBL2256575 0.81 OPRM1 (0.67) OPRM1MEN1KMT2ACYP2C9GRIN2D
SCHEMBL2256573 0.81 OPRM1 (0.67) OPRM1MEN1KMT2ACYP2C9GRIN2D
Bromide SCHEMBL28969840 0.78 OPRM1 (0.64) OPRM1MEN1KMT2ACYP2C9GRIN2D
Ammonia Solution, Strong SCHEMBL1158702 0.78 OPRM1 (0.64) OPRM1MEN1KMT2ACYP2C9GRIN2D
SCHEMBL28218849 0.78 OPRM1 (0.42) OPRM1MEN1KMT2ACYP2C9GRIN2D
SCHEMBL8330377 0.76 OPRM1 (0.37) OPRM1MEN1KMT2ACYP2C9GRIN2D
SCHEMBL1286640 0.76 MAOB (0.40) OPRM1MEN1KMT2ACYP2C9OPRK1
SCHEMBL42581 0.76 OPRL1 (0.52) OPRM1OPRK1OPRL1
SCHEMBL1366868 0.76 OPRL1 (0.41) OPRM1OPRK1OPRL1PNMTMAOA

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 50 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230285378-A1 Anti-Viral Compounds ABBVIE INC. (US) 2023-09-14 US disclosed
EP-3438106-A1 ANTI-VIRAL COMPOUNDS AbbVie Ireland Unlimited Company (IE) 2019-02-06 EP disclosed
US-20190015402-A1 Anti-Viral Compounds ABBVIE INC. (US) 2019-01-17 US disclosed
US-10039754-B2 Anti-viral compounds ABBVIE INC. (US) 2018-08-07 US disclosed
US-10028937-B2 Anti-viral compounds ABBVIE INC. (US) 2018-07-24 US disclosed
US-20170157105-A1 Anti-Viral Compounds ABBVIE INC. (US) 2017-06-08 US disclosed
US-20170157104-A1 Anti-Viral Compounds ABBVIE INC. (US) 2017-06-08 US disclosed
EP-2678334-B1 ANTI-VIRAL COMPOUNDS ABBVIE BAHAMAS LTD (BS) 2017-03-22 EP disclosed
US-9586978-B2 Anti-viral compounds ABBVIE INC. (US) 2017-03-07 US disclosed
US-9394279-B2 Anti-viral compounds ABBVIE INC. (US) 2016-07-19 US disclosed
WO-2012083053-A2 ANTI-VIRAL COMPOUNDS ABBOTT LABORATORIES (US) 2012-06-21 WO disclosed
WO-2012083170-A1 ANTI-VIRAL COMPOUNDS ABBOTT LABORATORIES (US) 2012-06-21 WO disclosed
WO-2012083058-A2 ANTI-VIRAL COMPOUNDS ABBOTT LABORATORIES (US) 2012-06-21 WO disclosed
WO-2012083164-A1 ANTI-VIRAL COMPOUNDS ABBOTT LABORATORIES (US) 2012-06-21 WO disclosed
US-20120115918-A1 Anti-Viral Compounds ABBOTT LABORATORIES (US) 2012-05-10 US disclosed
WO-2012051361-A1 ANTI-VIRAL COMPOUNDS ABBOTT LABORATORIES (US) 2012-04-19 WO disclosed
US-20120004196-A1 Anti-Viral Compounds Abbott Labaoratories (US) 2012-01-05 US disclosed
US-20110207699-A1 Anti-Viral Compounds Abbott Labaoratories (US) 2011-08-25 US disclosed
US-20110092415-A1 Anti-Viral Compounds Abbott Labaoratories (US) 2011-04-21 US disclosed
WO-1998051311-A2 DIHYDROPYRIMIDINES AND USES THEREOF SYNAPTIC PHARMACEUTICAL CORPORATION (US) 1998-11-19 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 (10 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-10028937-B2 Anti-viral compounds HAVCR2, EIF2AK2, MAVS OPRM1 2336/4885MEN1 4681/4885KMT2A 4093/4885
US-20230285378-A1 Anti-Viral Compounds HAVCR2, EIF2AK2, MAVS OPRM1 2336/4885MEN1 4681/4885KMT2A 4093/4885
US-20120115918-A1 Anti-Viral Compounds HAVCR2, EIF2AK2, MAVS OPRM1 2336/4885MEN1 4681/4885KMT2A 4093/4885
US-20170157105-A1 Anti-Viral Compounds HAVCR2, EIF2AK2, MAVS OPRM1 2336/4885MEN1 4681/4885KMT2A 4093/4885
US-20110092415-A1 Anti-Viral Compounds HAVCR2, EIF2AK2, MAVS OPRM1 2336/4885MEN1 4681/4885KMT2A 4093/4885
US-20170157104-A1 Anti-Viral Compounds HAVCR2, EIF2AK2, MAVS OPRM1 2336/4885MEN1 4681/4885KMT2A 4093/4885
US-20110207699-A1 Anti-Viral Compounds HAVCR2, EIF2AK2, MAVS OPRM1 2336/4885MEN1 4681/4885KMT2A 4093/4885
US-20190015402-A1 Anti-Viral Compounds HAVCR2, EIF2AK2, MAVS OPRM1 2336/4885MEN1 4681/4885KMT2A 4093/4885
US-20120004196-A1 Anti-Viral Compounds HAVCR2, EIF2AK2, MAVS OPRM1 2336/4885MEN1 4681/4885KMT2A 4093/4885
US-10039754-B2 Anti-viral compounds HAVCR2, EIF2AK2, MAVS OPRM1 2336/4885MEN1 4681/4885KMT2A 4093/4885

“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.