SCHEMBL6841566

SCHEMBL6841566

O=C(O)C1(CCc2ccc(Cl)cc2)CCN(CC2CC2)CC1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 2/20 0.48
OPRL1 P41146 1/20 0.48
HRH3 Q9Y5N1 1/20 0.44
LMNA P02545 2/20 0.43
KDM2B Q8NHM5 2/20 0.43
MC4R P32245 1/20 0.42
TP53 P04637 1/20 0.41
MAPT P10636 1/20 0.41
MEN1 O00255 1/20 0.40
POLB P06746 1/20 0.40
KMT2A Q03164 1/20 0.40
CCR5 P51681 3/20 0.40
OPRD1 P41143 1/20 0.40
OPRK1 P41145 1/20 0.40

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
SCHEMBL6840809 0.84 LMNA (0.60) OPRM1LMNAMEN1POLBKMT2A
SCHEMBL7769506 0.81 MEN1 (0.43) LMNAMAPTMEN1POLBKMT2A
SCHEMBL6841091 0.80 HSD11B1 (0.42) LMNAKDM2BMAPTMEN1POLB
Chlorobenzene SCHEMBL28751594 0.79 OPRM1 (0.46) OPRM1OPRL1HRH3KDM2BMEN1
Hydrochloric Acid SCHEMBL8875080 0.71 OPRM1 (0.53) OPRM1OPRL1HRH3LMNAKDM2B
SCHEMBL2460473 0.71 OPRM1 (0.53) OPRM1OPRL1LMNAKDM2BTP53
SCHEMBL2460474 0.71 OPRM1 (0.53) OPRM1OPRL1LMNAKDM2BTP53
SCHEMBL17590663 0.71 ALDH1A1 (0.40) MEN1KMT2A
SCHEMBL13636510 0.71 HRH3 (0.66) HRH3LMNAMAPTMEN1POLB
Hydrochloric Acid SCHEMBL5063044 0.70 HRH3 (0.68) HRH3LMNAMAPTMEN1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1635998-A Tricyclic analgesics WARNER LAMBERT CO (US) 2005-07-06 CN disclosed
US-20040266802-A1 Tricyclic analgesics CALVET ALAIN (US) 2004-12-30 US disclosed
EP-1235808-A2 TRICYCLIC ANALGESICS WARNER-LAMBERT COMPANY (US) 2002-09-04 EP disclosed
WO-2000075116-A2 TRICYCLIC ANALGESICS WARNER-LAMBERT COMPANY (US) 2000-12-14 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 (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-20040266802-A1 Tricyclic analgesics OPRM1, OPRL1, OPRD1 OPRM1 1/4885OPRL1 2/4885HRH3 112/4885

“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.