SCHEMBL6095538

SCHEMBL6095538

FC(F)(F)c1cccc(N2CCN(C(Cc3nc4ccccc4[nH]3)c3nc4ccccc4[nH]3)CC2)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 5/20 0.48
MAPT P10636 6/20 0.45
ALDH1A1 P00352 4/20 0.45
SMN1; SMN2 Q16637 4/20 0.45
TSHR P16473 2/20 0.45
NPSR1 Q6W5P4 2/20 0.45
PHGDH O43175 1/20 0.44
HTR1A P08908 2/20 0.44
ABCB11 O95342 1/20 0.44
ADRA2A P08913 1/20 0.44
ADORA3 P0DMS8 1/20 0.44
CHRM1 P11229 1/20 0.44
DRD1 P21728 1/20 0.44
TBXA2R P21731 1/20 0.44
SLC6A4 P31645 1/20 0.44
ADRA1A P35348 1/20 0.44
OPRM1 P35372 1/20 0.44
DRD3 P35462 1/20 0.44
KCNH2 Q12809 1/20 0.44
LMNA P02545 2/20 0.44

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
SCHEMBL6095412 0.89 DRD4 (0.50) DRD4MAPTALDH1A1SMN1; SMN2NPSR1
SCHEMBL6096282 0.75 DRD4 (0.65) DRD4MAPTALDH1A1SMN1; SMN2NPSR1
SCHEMBL6095533 0.74 DRD4 (0.56) DRD4ALDH1A1HTR1AABCB11ADRA2A
SCHEMBL6095618 0.70 CACNA1G (0.43) DRD4MAPTSMN1; SMN2TSHRNPSR1
SCHEMBL20063235 0.69 PHGDH (0.85) PHGDHLMNAMEN1KMT2A
SCHEMBL2422735 0.69 PHGDH (0.64) PHGDHADRA1AKCNH2
SCHEMBL28226906 0.69 ALDH1A1 (0.77) MAPTALDH1A1SMN1; SMN2TSHRNPSR1
SCHEMBL18658152 0.68 HTT (0.57) DRD4ALDH1A1HTR1AKCNH2LMNA
SCHEMBL23964164 0.68 DRD4 (0.68) DRD4HTR1AKCNH2GAAADRA2C
SCHEMBL11914802 0.67 ALDH1A1 (0.60) MAPTALDH1A1SMN1; SMN2TSHRNPSR1

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-7030150-B2 Benzimidazole compounds and antiviral uses thereof TRIMERIS, INC. 2006-04-18 US claimed
US-20030119754-A1 Benzimidazole compounds and antiviral uses thereof TRIMERIS, INC. 2003-06-26 US claimed
WO-2002092575-A1 BENZIMIDAZOLE COMPOUNDS AND ANTIVIRAL USES THEREOF TRIMERIS, INC. (US) 2002-11-21 WO claimed
US-20060142365-A1 Benzimidazole compounds and antiviral uses thereof TRIMERIS, INC. 2006-06-29 US disclosed
US-7030150-B2 Benzimidazole compounds and antiviral uses thereof TRIMERIS, INC. 2006-04-18 US disclosed
US-20030119754-A1 Benzimidazole compounds and antiviral uses thereof TRIMERIS, INC. 2003-06-26 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 (2 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-20060142365-A1 Benzimidazole compounds and antiviral uses thereof MAVS, ZC3HAV1, TIMM13 DRD4 1827/4885MAPT 4679/4885ALDH1A1 1618/4885
US-20030119754-A1 Benzimidazole compounds and antiviral uses thereof MAVS, ZC3HAV1, TIMM13 DRD4 1827/4885MAPT 4679/4885ALDH1A1 1618/4885

“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.