SCHEMBL20798157

SCHEMBL20798157

Fc1ccc(N2CC3(CN(Cc4ccccc4)C3)C2)nc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM4 P08173 2/20 0.47
RET P07949 1/20 0.44
ALDH1A1 P00352 1/20 0.43
MAPT P10636 1/20 0.43
NPBWR1 P48145 1/20 0.43
MCHR1 Q99705 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
CYP2D6 P10635 2/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
TSHR P16473 1/20 0.41
PARP1 P09874 2/20 0.41
PARP2 Q9UGN5 1/20 0.41
DRD4 P21917 3/20 0.40
DRD3 P35462 3/20 0.40
DRD2 P14416 2/20 0.40
HTR1A P08908 2/20 0.40
HTR2A P28223 2/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2C9 P11712 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
SCHEMBL20804885 0.83 MAPT (0.61) CHRM4ALDH1A1MAPTNPBWR1MCHR1
SCHEMBL27798357 0.76 SIGMAR1 (0.62) ALDH1A1CYP2D6MEN1KMT2ATSHR
SCHEMBL25696351 0.76 AVPR1A (0.45) DRD4DRD3DRD2HTR1AHTR2A
SCHEMBL25720129 0.75 GRM1 (0.40) ALDH1A1AVPR2
SCHEMBL14892774 0.74 DRD4 (0.59) CYP2D6MEN1KMT2ATSHRDRD4
SCHEMBL20798102 0.73 AVPR1A (0.44) ALDH1A1PARP1PARP2CYP1A2AVPR2
SCHEMBL14089988 0.72 MC4R (0.58) ALDH1A1CYP2D6MEN1KMT2ATSHR
SCHEMBL17706684 0.72 SIGMAR1 (0.52) ALDH1A1CYP2D6MEN1KMT2ATSHR
SCHEMBL30058086 0.71 GRM1 (0.48) ALDH1A1CYP2D6TSHRCYP2C9AVPR2
SCHEMBL22756724 0.71 DHFR (0.42) AVPR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12152038-B2 Vasopressin receptor antagonists and products and methods related thereto Neumora Therapeutics, Inc. (US) 2024-11-26 US disclosed
EP-3679043-B9 VASOPRESSIN RECEPTOR ANTAGONISTS AND PRODUCTS AND METHODS RELATED THERETO NEUMORA THERAPEUTICS INC (US) 2023-09-27 EP disclosed
EP-3679043-B9 VASOPRESSIN RECEPTOR ANTAGONISTS AND PRODUCTS AND METHODS RELATED THERETO NEUMORA THERAPEUTICS INC (US) 2023-09-27 EP disclosed
EP-3679043-B1 VASOPRESSIN RECEPTOR ANTAGONISTS AND PRODUCTS AND METHODS RELATED THERETO NEUMORA THERAPEUTICS INC (US) 2023-05-31 EP disclosed
EP-3679043-B1 VASOPRESSIN RECEPTOR ANTAGONISTS AND PRODUCTS AND METHODS RELATED THERETO NEUMORA THERAPEUTICS INC (US) 2023-05-31 EP disclosed
US-20210317126-A1 VASOPRESSIN RECEPTOR ANTAGONISTS AND PRODUCTS AND METHODS RELATED THERETO BLACKTHORN THERAPEUTICS, INC. 2021-10-14 US disclosed
US-20210317126-A1 VASOPRESSIN RECEPTOR ANTAGONISTS AND PRODUCTS AND METHODS RELATED THERETO BLACKTHORN THERAPEUTICS, INC. 2021-10-14 US disclosed
EP-3679043-A1 VASOPRESSIN RECEPTOR ANTAGONISTS AND PRODUCTS AND METHODS RELATED THERETO Blackthorn Therapeutics, Inc. (US) 2020-07-15 EP disclosed
US-20190169202-A1 VASOPRESSIN RECEPTOR ANTAGONISTS AND PRODUCTS AND METHODS RELATED THERETO Neumora Therapeutics, Inc. 2019-06-06 US disclosed
US-20190169202-A1 VASOPRESSIN RECEPTOR ANTAGONISTS AND PRODUCTS AND METHODS RELATED THERETO Neumora Therapeutics, Inc. 2019-06-06 US disclosed
WO-2019050988-A1 VASOPRESSIN RECEPTOR ANTAGONISTS AND PRODUCTS AND METHODS RELATED THERETO BLACKTHORN THERAPEUTICS, INC. (US) 2019-03-14 WO disclosed
WO-2019050988-A1 VASOPRESSIN RECEPTOR ANTAGONISTS AND PRODUCTS AND METHODS RELATED THERETO BLACKTHORN THERAPEUTICS, INC. (US) 2019-03-14 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 (3 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-12152038-B2 Vasopressin receptor antagonists and products and methods related thereto AVPR1A, AVPR2, AVPR1B CHRM4 732/4885RET 936/4885ALDH1A1 2907/4885
US-20210317126-A1 VASOPRESSIN RECEPTOR ANTAGONISTS AND PRODUCTS AND METHODS RELATED THERETO AVPR1A, AVPR2, AVPR1B CHRM4 732/4885RET 936/4885ALDH1A1 2907/4885
US-20190169202-A1 VASOPRESSIN RECEPTOR ANTAGONISTS AND PRODUCTS AND METHODS RELATED THERETO AVPR1A, AVPR2, AVPR1B CHRM4 732/4885RET 936/4885ALDH1A1 2907/4885

“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.