SCHEMBL10424979

SCHEMBL10424979

CN(C)CCN1CCC(Oc2c(F)c(F)c(F)c(F)c2F)CC1

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CARM1 Q86X55 3/20 0.35
PRMT6 Q96LA8 3/20 0.35
HRH3 Q9Y5N1 3/20 0.34
LSS P48449 1/20 0.34
HTR2A P28223 1/20 0.34
SLC6A3 Q01959 1/20 0.33
KCNH2 Q12809 1/20 0.33
SLC6A5 Q9Y345 1/20 0.33
ACKR3 P25106 1/20 0.31

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
Hydrochloric Acid SCHEMBL10424444 0.98 LSS (0.36) CARM1PRMT6HRH3LSSHTR2A
SCHEMBL10460534 0.91 ALOX15 (0.40) CARM1PRMT6HRH3LSSSLC6A5
Hydrochloric Acid SCHEMBL10424978 0.90 ALOX15 (0.39) CARM1PRMT6HRH3LSSSLC6A5
Hydrochloric Acid SCHEMBL10424434 0.90 ALOX15 (0.39) CARM1PRMT6HRH3LSSSLC6A5
SCHEMBL10423372 0.79 ALOX15 (0.40) CARM1PRMT6HRH3HTR2A
SCHEMBL10423406 0.78 HRH3 (0.47) CARM1PRMT6HRH3
SCHEMBL10423401 0.78 CARM1 (0.58) CARM1PRMT6HRH3
SCHEMBL10423366 0.76 HRH3 (0.42) HRH3SLC6A3KCNH2
SCHEMBL24351019 0.74 LMNA (0.36) CARM1PRMT6HRH3SLC6A3KCNH2
Hydrochloric Acid SCHEMBL10424431 0.74 SMN1; SMN2 (0.41) HRH3SLC6A3KCNH2

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
US-4954511-A ALLEVIATING PAIN, TREATING DEPRESSION, CONVULSIONS AND HYPERTENSION HOECHST-ROUSSELL PHARMACEUTICALS INC. (US) 1990-09-04 US claimed
US-4954511-A ALLEVIATING PAIN, TREATING DEPRESSION, CONVULSIONS AND HYPERTENSION HOECHST-ROUSSELL PHARMACEUTICALS INC. (US) 1990-09-04 US disclosed
US-4914204-A ANALGESICS, ANTIDEPRESSANTS, ANTICONVULSANTS, HYPOTENSIVE AGENTS HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1990-04-03 US disclosed
EP-0333027-A1 4-Pentafluorophenoxypiperidines, a process for their preparation and their use as medicaments HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1989-09-20 EP disclosed