SCHEMBL11507790

SCHEMBL11507790

O=c1[nH]c2cc(Cl)c(Cl)cc2n1CCCN1CCC(O)(c2ccc(Cl)cc2)CC1

nearest known ligand 0.52

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ DRD2 P14416 7/20 0.51
▸ ADRA1A P35348 1/20 0.51
▸ CCR3 P51677 1/20 0.51
▸ CCR1 P32246 6/20 0.50

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
SCHEMBL11508526 0.91 DRD2 (0.52) DRD2ADRA1ACCR3CCR1
SCHEMBL11508308 0.91 DRD2 (0.56) DRD2ADRA1ACCR3CCR1
Hydrochloric Acid SCHEMBL11506955 0.89 DRD2 (0.51) DRD2ADRA1ACCR3CCR1
SCHEMBL11509380 0.87 DRD2 (0.48) DRD2ADRA1ACCR3CCR1
SCHEMBL11507337 0.86 HTR7 (0.62) DRD2ADRA1ACCR3CCR1
SCHEMBL11506895 0.84 CCR1 (0.53) DRD2ADRA1ACCR3CCR1
SCHEMBL11507328 0.84 HTR7 (0.66) DRD2ADRA1ACCR3CCR1
SCHEMBL464535 0.80 SLC6A1 (0.56) DRD2ADRA1ACCR3CCR1
SCHEMBL11506081 0.80 OPRM1 (0.54) DRD2ADRA1A
SCHEMBL11506921 0.76 LMNA (0.60) DRD2ADRA1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4175129-A Antiemetic 1-(benzoxazolylalkyl)-piperidine derivatives JANSSEN PHARMACEUTICA N.V. (BE) 1979-11-20 — — US disclosed
US-4160836-A Antiemetic 1-(benzothiazolylalkyl)piperidine derivatives JANSSEN PHARMACEUTICA N.V. (BE) 1979-07-10 — — US disclosed
US-4126688-A ANTIEMETIC 1-(BENZOTRIAZOLYL-ALKYL)-PIPERIDINE DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 1978-11-21 — — US disclosed
US-4126687-A ANTIEMETIC, 1-(BENZIMIDAZOLYL-ALKYL)-PIPERIDINE DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 1978-11-21 — — US disclosed
US-4110333-A ANTIEMETIC INTERMEDIATES JANSSEN PHARMACEUTICA N.V. (BE) 1978-08-29 — — US disclosed
US-4066772-A ANTIEMETICS JANSSEN PHARMACEUTICA N.V. (BE) 1978-01-03 — — US disclosed
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